(11-cyclopentylbenzo[a]fluoren-11-yl) 2-methylprop-2-enoate;(11-cyclopentylbenzo[b]fluoren-11-yl) 2-methylprop-2-enoate;(7-ethenylbenzo[c]fluoren-7-yl) 2-methylprop-2-enoate;(11-ethynylbenzo[a]fluoren-11-yl) 2-methylprop-2-enoate;(11-ethynylbenzo[b]fluoren-11-yl) 2-methylprop-2-enoate;(7-ethynylbenzo[c]fluoren-7-yl) 2-methylprop-2-enoate;[11-[(E)-prop-1-enyl]benzo[a]fluoren-11-yl] 2-methylprop-2-enoate;[11-[(E)-prop-1-enyl]benzo[b]fluoren-11-yl] 2-methylprop-2-enoate;[7-[(E)-prop-1-enyl]benzo[c]fluoren-7-yl] 2-methylprop-2-enoate

C216H174O18 — CID 159104116

IUPAC(11-cyclopentylbenzo[a]fluoren-11-yl) 2-methylprop-2-enoate;(11-cyclopentylbenzo[b]fluoren-11-yl) 2-methylprop-2-enoate;(7-ethenylbenzo[c]fluoren-7-yl) 2-methylprop-2-enoate;(11-ethynylbenzo[a]fluoren-11-yl) 2-methylprop-2-enoate;(11-ethynylbenzo[b]fluoren-11-yl) 2-methylprop-2-enoate;(7-ethynylbenzo[c]fluoren-7-yl) 2-methylprop-2-enoate;[11-[(E)-prop-1-enyl]benzo[a]fluoren-11-yl] 2-methylprop-2-enoate;[11-[(E)-prop-1-enyl]benzo[b]fluoren-11-yl] 2-methylprop-2-enoate;[7-[(E)-prop-1-enyl]benzo[c]fluoren-7-yl] 2-methylprop-2-enoate
SMILESC#CC1(OC(=O)C(=C)C)c2ccccc2-c2c1ccc1ccccc21.C#CC1(OC(=O)C(=C)C)c2ccccc2-c2cc3ccccc3cc21.C#CC1(OC(=O)C(=C)C)c2ccccc2-c2ccc3ccccc3c21.C=C(C)C(=O)OC1(/C=C/C)c2ccccc2-c2c1ccc1ccccc21.C=C(C)C(=O)OC1(/C=C/C)c2ccccc2-c2cc3ccccc3cc21.C=C(C)C(=O)OC1(/C=C/C)c2ccccc2-c2ccc3ccccc3c21.C=C(C)C(=O)OC1(C2CCCC2)c2ccccc2-c2cc3ccccc3cc21.C=C(C)C(=O)OC1(C2CCCC2)c2ccccc2-c2ccc3ccccc3c21.C=CC1(OC(=O)C(=C)C)c2ccccc2-c2c1ccc1ccccc21
InChIInChI=1S/2C26H24O2.3C24H20O2.2C23H16O2.C23H18O2.C23H16O2/c1-17(2)25(27)28-26(19-10-4-5-11-19)23-14-8-7-13-21(23)22-16-15-18-9-3-6-12-20(18)24(22)26;1-17(2)25(27)28-26(20-11-5-6-12-20)23-14-8-7-13-21(23)22-15-18-9-3-4-10-19(18)16-24(22)26;1-4-15-24(26-23(25)16(2)3)21-12-8-7-11-19(21)20-14-13-17-9-5-6-10-18(17)22(20)24;1-4-15-24(26-23(25)16(2)3)20-12-8-7-11-19(20)22-18-10-6-5-9-17(18)13-14-21(22)24;1-4-13-24(26-23(25)16(2)3)21-12-8-7-11-19(21)20-14-17-9-5-6-10-18(17)15-22(20)24;1-4-23(25-22(24)15(2)3)20-12-8-7-11-18(20)19-13-16-9-5-6-10-17(16)14-21(19)23;1-4-23(25-22(24)15(2)3)20-12-8-7-11-18(20)19-14-13-16-9-5-6-10-17(16)21(19)23;2*1-4-23(25-22(24)15(2)3)19-12-8-7-11-18(19)21-17-10-6-5-9-16(17)13-14-20(21)23/h3,6-9,12-16,19H,1,4-5,10-11H2,2H3;3-4,7-10,13-16,20H,1,5-6,11-12H2,2H3;3*4-15H,2H2,1,3H3;2*1,5-14H,2H2,3H3;4-14H,1-2H2,3H3;1,5-14H,2H2,3H3/b;;2*15-4+;13-4+;;;;
InChIKeyKDQTWBYRJOCXKR-QWCBFFIGSA-N
MW3057.75 g/mol
LogP49.84
Rot. Bonds24

About (11-cyclopentylbenzo[a]fluoren-11-yl) 2-methylprop-2-enoate;(11-cyclopentylbenzo[b]fluoren-11-yl) 2-methylprop-2-enoate;(7-ethenylbenzo[c]fluoren-7-yl) 2-methylprop-2-enoate;(11-ethynylbenzo[a]fluoren-11-yl) 2-methylprop-2-enoate;(11-ethynylbenzo[b]fluoren-11-yl) 2-methylprop-2-enoate;(7-ethynylbenzo[c]fluoren-7-yl) 2-methylprop-2-enoate;[11-[(E)-prop-1-enyl]benzo[a]fluoren-11-yl] 2-methylprop-2-enoate;[11-[(E)-prop-1-enyl]benzo[b]fluoren-11-yl] 2-methylprop-2-enoate;[7-[(E)-prop-1-enyl]benzo[c]fluoren-7-yl] 2-methylprop-2-enoate

(11-cyclopentylbenzo[a]fluoren-11-yl) 2-methylprop-2-enoate;(11-cyclopentylbenzo[b]fluoren-11-yl) 2-methylprop-2-enoate;(7-ethenylbenzo[c]fluoren-7-yl) 2-methylprop-2-enoate;(11-ethynylbenzo[a]fluoren-11-yl) 2-methylprop-2-enoate;(11-ethynylbenzo[b]fluoren-11-yl) 2-methylprop-2-enoate;(7-ethynylbenzo[c]fluoren-7-yl) 2-methylprop-2-enoate;[11-[(E)-prop-1-enyl]benzo[a]fluoren-11-yl] 2-methylprop-2-enoate;[11-[(E)-prop-1-enyl]benzo[b]fluoren-11-yl] 2-methylprop-2-enoate;[7-[(E)-prop-1-enyl]benzo[c]fluoren-7-yl] 2-methylprop-2-enoate (PubChem CID 159104116) has the molecular formula C216H174O18 and a molecular weight of 3057.75 g/mol. Its IUPAC name is (11-cyclopentylbenzo[a]fluoren-11-yl) 2-methylprop-2-enoate;(11-cyclopentylbenzo[b]fluoren-11-yl) 2-methylprop-2-enoate;(7-ethenylbenzo[c]fluoren-7-yl) 2-methylprop-2-enoate;(11-ethynylbenzo[a]fluoren-11-yl) 2-methylprop-2-enoate;(11-ethynylbenzo[b]fluoren-11-yl) 2-methylprop-2-enoate;(7-ethynylbenzo[c]fluoren-7-yl) 2-methylprop-2-enoate;[11-[(E)-prop-1-enyl]benzo[a]fluoren-11-yl] 2-methylprop-2-enoate;[11-[(E)-prop-1-enyl]benzo[b]fluoren-11-yl] 2-methylprop-2-enoate;[7-[(E)-prop-1-enyl]benzo[c]fluoren-7-yl] 2-methylprop-2-enoate.

Molecular Properties

Compound Name(11-cyclopentylbenzo[a]fluoren-11-yl) 2-methylprop-2-enoate;(11-cyclopentylbenzo[b]fluoren-11-yl) 2-methylprop-2-enoate;(7-ethenylbenzo[c]fluoren-7-yl) 2-methylprop-2-enoate;(11-ethynylbenzo[a]fluoren-11-yl) 2-methylprop-2-enoate;(11-ethynylbenzo[b]fluoren-11-yl) 2-methylprop-2-enoate;(7-ethynylbenzo[c]fluoren-7-yl) 2-methylprop-2-enoate;[11-[(E)-prop-1-enyl]benzo[a]fluoren-11-yl] 2-methylprop-2-enoate;[11-[(E)-prop-1-enyl]benzo[b]fluoren-11-yl] 2-methylprop-2-enoate;[7-[(E)-prop-1-enyl]benzo[c]fluoren-7-yl] 2-methylprop-2-enoate
PubChem CID159104116
Molecular FormulaC216H174O18
Molecular Weight3057.75 g/mol
Exact Mass3055.27
IUPAC Name(11-cyclopentylbenzo[a]fluoren-11-yl) 2-methylprop-2-enoate;(11-cyclopentylbenzo[b]fluoren-11-yl) 2-methylprop-2-enoate;(7-ethenylbenzo[c]fluoren-7-yl) 2-methylprop-2-enoate;(11-ethynylbenzo[a]fluoren-11-yl) 2-methylprop-2-enoate;(11-ethynylbenzo[b]fluoren-11-yl) 2-methylprop-2-enoate;(7-ethynylbenzo[c]fluoren-7-yl) 2-methylprop-2-enoate;[11-[(E)-prop-1-enyl]benzo[a]fluoren-11-yl] 2-methylprop-2-enoate;[11-[(E)-prop-1-enyl]benzo[b]fluoren-11-yl] 2-methylprop-2-enoate;[7-[(E)-prop-1-enyl]benzo[c]fluoren-7-yl] 2-methylprop-2-enoate
SMILESC#CC1(OC(=O)C(=C)C)c2ccccc2-c2c1ccc1ccccc21.C#CC1(OC(=O)C(=C)C)c2ccccc2-c2cc3ccccc3cc21.C#CC1(OC(=O)C(=C)C)c2ccccc2-c2ccc3ccccc3c21.C=C(C)C(=O)OC1(/C=C/C)c2ccccc2-c2c1ccc1ccccc21.C=C(C)C(=O)OC1(/C=C/C)c2ccccc2-c2cc3ccccc3cc21.C=C(C)C(=O)OC1(/C=C/C)c2ccccc2-c2ccc3ccccc3c21.C=C(C)C(=O)OC1(C2CCCC2)c2ccccc2-c2cc3ccccc3cc21.C=C(C)C(=O)OC1(C2CCCC2)c2ccccc2-c2ccc3ccccc3c21.C=CC1(OC(=O)C(=C)C)c2ccccc2-c2c1ccc1ccccc21
InChIInChI=1S/2C26H24O2.3C24H20O2.2C23H16O2.C23H18O2.C23H16O2/c1-17(2)25(27)28-26(19-10-4-5-11-19)23-14-8-7-13-21(23)22-16-15-18-9-3-6-12-20(18)24(22)26;1-17(2)25(27)28-26(20-11-5-6-12-20)23-14-8-7-13-21(23)22-15-18-9-3-4-10-19(18)16-24(22)26;1-4-15-24(26-23(25)16(2)3)21-12-8-7-11-19(21)20-14-13-17-9-5-6-10-18(17)22(20)24;1-4-15-24(26-23(25)16(2)3)20-12-8-7-11-19(20)22-18-10-6-5-9-17(18)13-14-21(22)24;1-4-13-24(26-23(25)16(2)3)21-12-8-7-11-19(21)20-14-17-9-5-6-10-18(17)15-22(20)24;1-4-23(25-22(24)15(2)3)20-12-8-7-11-18(20)19-13-16-9-5-6-10-17(16)14-21(19)23;1-4-23(25-22(24)15(2)3)20-12-8-7-11-18(20)19-14-13-16-9-5-6-10-17(16)21(19)23;2*1-4-23(25-22(24)15(2)3)19-12-8-7-11-18(19)21-17-10-6-5-9-16(17)13-14-20(21)23/h3,6-9,12-16,19H,1,4-5,10-11H2,2H3;3-4,7-10,13-16,20H,1,5-6,11-12H2,2H3;3*4-15H,2H2,1,3H3;2*1,5-14H,2H2,3H3;4-14H,1-2H2,3H3;1,5-14H,2H2,3H3/b;;2*15-4+;13-4+;;;;
InChIKeyKDQTWBYRJOCXKR-QWCBFFIGSA-N
XLogP49.84
TPSA236.70 Ų
H-Bond Donors
H-Bond Acceptors18
Rotatable Bonds24
Heavy Atoms234
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003057.75
LogP ≤ 549.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1018

Computed Properties (RDKit)

Structural Alerts{'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

Analyze (11-cyclopentylbenzo[a]fluoren-11-yl) 2-methylprop-2-enoate;(11-cyclopentylbenzo[b]fluoren-11-yl) 2-methylprop-2-enoate;(7-ethenylbenzo[c]fluoren-7-yl) 2-methylprop-2-enoate;(11-ethynylbenzo[a]fluoren-11-yl) 2-methylprop-2-enoate;(11-ethynylbenzo[b]fluoren-11-yl) 2-methylprop-2-enoate;(7-ethynylbenzo[c]fluoren-7-yl) 2-methylprop-2-enoate;[11-[(E)-prop-1-enyl]benzo[a]fluoren-11-yl] 2-methylprop-2-enoate;[11-[(E)-prop-1-enyl]benzo[b]fluoren-11-yl] 2-methylprop-2-enoate;[7-[(E)-prop-1-enyl]benzo[c]fluoren-7-yl] 2-methylprop-2-enoate with MolForge

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Related Compounds

(11-cyclopentylbenzo[a]fluoren-11-yl) 2-methylprop-2-enoate;(11-ethenylbenzo[a]fluoren-11-yl) 2-methylprop-2-enoate;(11-ethenylbenzo[b]fluoren-11-yl) 2-methylprop-2-enoate;(7-ethenylbenzo[c]fluoren-7-yl) 2-methylprop-2-enoate;(11-ethynylbenzo[a]fluoren-11-yl) 2-methylprop-2-enoate;(11-ethynylbenzo[b]fluoren-11-yl) 2-methylprop-2-enoate;(7-ethynylbenzo[c]fluoren-7-yl) 2-methylprop-2-enoate;[11-[(E)-prop-1-enyl]benzo[a]fluoren-11-yl] 2-methylprop-2-enoate;[11-[(E)-prop-1-enyl]benzo[b]fluoren-11-yl] 2-methylprop-2-enoate;[7-[(E)-prop-1-enyl]benzo[c]fluoren-7-yl] 2-methylprop-2-enoate
CID 157491019
(11-cyclopentylbenzo[a]fluoren-11-yl) 2-methylprop-2-enoate;(11-cyclopentylbenzo[b]fluoren-11-yl) 2-methylprop-2-enoate;(7-cyclopentylbenzo[c]fluoren-7-yl) 2-methylprop-2-enoate;(11-cyclopropylbenzo[a]fluoren-11-yl) 2-methylprop-2-enoate;(11-cyclopropylbenzo[b]fluoren-11-yl) 2-methylprop-2-enoate;(7-cyclopropylbenzo[c]fluoren-7-yl) 2-methylprop-2-enoate;[11-[(E)-prop-1-enyl]benzo[a]fluoren-11-yl] 2-methylprop-2-enoate;[11-[(E)-prop-1-enyl]benzo[b]fluoren-11-yl] 2-methylprop-2-enoate;[7-[(E)-prop-1-enyl]benzo[c]fluoren-7-yl] 2-methylprop-2-enoate
CID 162234632
(11-ethenylbenzo[a]fluoren-11-yl) 2-methylprop-2-enoate;(11-ethenylbenzo[b]fluoren-11-yl) 2-methylprop-2-enoate;(7-ethenylbenzo[c]fluoren-7-yl) 2-methylprop-2-enoate;(11-ethynylbenzo[a]fluoren-11-yl) 2-methylprop-2-enoate;(11-propan-2-ylbenzo[b]fluoren-11-yl) 2-methylprop-2-enoate;(7-propan-2-ylbenzo[c]fluoren-7-yl) 2-methylprop-2-enoate
CID 158883874
(11-ethynylbenzo[b]fluoren-11-yl) 2-methylprop-2-enoate
CID 59476795
[(7S)-7-cyclopentylbenzo[a]phenalen-7-yl] 2-methylprop-2-enoate
CID 130411370
[4-[11-(2,2-dimethylpropanoyloxy)-11-ethenylbenzo[a]fluoren-8-yl]-7-ethenylbenzo[c]fluoren-7-yl] 2,2-dimethylpropanoate
CID 130411241
(9-ethenylfluoren-9-yl) 2-methylprop-2-enoate
CID 59476828
(7-propan-2-ylbenzo[c]fluoren-7-yl) 2-methylprop-2-enoate
CID 59476831
(9-benzyl-10-oxoanthracen-9-yl) 2-methylprop-2-enoate;(9-butyl-10-oxoanthracen-9-yl) 2-methylprop-2-enoate;(9-cyclohexyl-10-oxoanthracen-9-yl) 2-methylprop-2-enoate;(9-cyclohexylthioxanthen-9-yl) 2-methylprop-2-enoate;(9-cyclohexylxanthen-9-yl) 2-methylprop-2-enoate;(9-ethenyl-10-oxoanthracen-9-yl) 2-methylprop-2-enoate;(9-ethynyl-10-oxoanthracen-9-yl) 2-methylprop-2-enoate;(10-oxo-9-phenylanthracen-9-yl) 2-methylprop-2-enoate;(10-oxo-9-prop-2-enylanthracen-9-yl) 2-methylprop-2-enoate;(10-oxo-9-prop-2-ynylanthracen-9-yl) 2-methylprop-2-enoate;(9-phenylthioxanthen-9-yl) 2-methylprop-2-enoate;(9-phenylxanthen-9-yl) 2-methylprop-2-enoate
CID 158150430
11,11-dimethylbenzo[a]fluorene;11,11-dimethylbenzo[b]fluorene;7,7-dimethylbenzo[c]fluorene;9,9-dimethylfluorene;8,8-dimethylindeno[1,2-a]anthracene;13,13-dimethylindeno[2,1-a]anthracene;10,10-dimethylpentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(21),2,4,6,8,11,13,15,17,19-decaene;ethane
CID 159108274
(9-benzyl-10-oxothioxanthen-9-yl) 2-methylprop-2-enoate;(9-butyl-10-oxothioxanthen-9-yl) 2-methylprop-2-enoate;(9-cyclohexyl-10-oxothioxanthen-9-yl) 2-methylprop-2-enoate;(9-cyclopentyl-10-oxothioxanthen-9-yl) 2-methylprop-2-enoate;(9-ethenyl-10-oxothioxanthen-9-yl) 2-methylprop-2-enoate;(9-ethyl-10-oxothioxanthen-9-yl) 2-methylprop-2-enoate;(9-ethynyl-10-oxothioxanthen-9-yl) 2-methylprop-2-enoate;(10-oxo-9-phenylthioxanthen-9-yl) 2-methylprop-2-enoate;(10-oxo-9-propan-2-ylthioxanthen-9-yl) 2-methylprop-2-enoate;(10-oxo-9-prop-2-enylthioxanthen-9-yl) 2-methylprop-2-enoate;(10-oxo-9-propylthioxanthen-9-yl) 2-methylprop-2-enoate
CID 157258457
[1-[2-(2-methylprop-2-enoyloxy)naphthalen-1-yl]naphthalen-2-yl] 2-methylprop-2-enoate
CID 58341857

Frequently Asked Questions

What is the IUPAC name of (11-cyclopentylbenzo[a]fluoren-11-yl) 2-methylprop-2-enoate;(11-cyclopentylbenzo[b]fluoren-11-yl) 2-methylprop-2-enoate;(7-ethenylbenzo[c]fluoren-7-yl) 2-methylprop-2-enoate;(11-ethynylbenzo[a]fluoren-11-yl) 2-methylprop-2-enoate;(11-ethynylbenzo[b]fluoren-11-yl) 2-methylprop-2-enoate;(7-ethynylbenzo[c]fluoren-7-yl) 2-methylprop-2-enoate;[11-[(E)-prop-1-enyl]benzo[a]fluoren-11-yl] 2-methylprop-2-enoate;[11-[(E)-prop-1-enyl]benzo[b]fluoren-11-yl] 2-methylprop-2-enoate;[7-[(E)-prop-1-enyl]benzo[c]fluoren-7-yl] 2-methylprop-2-enoate?
The IUPAC name of (11-cyclopentylbenzo[a]fluoren-11-yl) 2-methylprop-2-enoate;(11-cyclopentylbenzo[b]fluoren-11-yl) 2-methylprop-2-enoate;(7-ethenylbenzo[c]fluoren-7-yl) 2-methylprop-2-enoate;(11-ethynylbenzo[a]fluoren-11-yl) 2-methylprop-2-enoate;(11-ethynylbenzo[b]fluoren-11-yl) 2-methylprop-2-enoate;(7-ethynylbenzo[c]fluoren-7-yl) 2-methylprop-2-enoate;[11-[(E)-prop-1-enyl]benzo[a]fluoren-11-yl] 2-methylprop-2-enoate;[11-[(E)-prop-1-enyl]benzo[b]fluoren-11-yl] 2-methylprop-2-enoate;[7-[(E)-prop-1-enyl]benzo[c]fluoren-7-yl] 2-methylprop-2-enoate (CID 159104116) is (11-cyclopentylbenzo[a]fluoren-11-yl) 2-methylprop-2-enoate;(11-cyclopentylbenzo[b]fluoren-11-yl) 2-methylprop-2-enoate;(7-ethenylbenzo[c]fluoren-7-yl) 2-methylprop-2-enoate;(11-ethynylbenzo[a]fluoren-11-yl) 2-methylprop-2-enoate;(11-ethynylbenzo[b]fluoren-11-yl) 2-methylprop-2-enoate;(7-ethynylbenzo[c]fluoren-7-yl) 2-methylprop-2-enoate;[11-[(E)-prop-1-enyl]benzo[a]fluoren-11-yl] 2-methylprop-2-enoate;[11-[(E)-prop-1-enyl]benzo[b]fluoren-11-yl] 2-methylprop-2-enoate;[7-[(E)-prop-1-enyl]benzo[c]fluoren-7-yl] 2-methylprop-2-enoate.
What is the SMILES notation for (11-cyclopentylbenzo[a]fluoren-11-yl) 2-methylprop-2-enoate;(11-cyclopentylbenzo[b]fluoren-11-yl) 2-methylprop-2-enoate;(7-ethenylbenzo[c]fluoren-7-yl) 2-methylprop-2-enoate;(11-ethynylbenzo[a]fluoren-11-yl) 2-methylprop-2-enoate;(11-ethynylbenzo[b]fluoren-11-yl) 2-methylprop-2-enoate;(7-ethynylbenzo[c]fluoren-7-yl) 2-methylprop-2-enoate;[11-[(E)-prop-1-enyl]benzo[a]fluoren-11-yl] 2-methylprop-2-enoate;[11-[(E)-prop-1-enyl]benzo[b]fluoren-11-yl] 2-methylprop-2-enoate;[7-[(E)-prop-1-enyl]benzo[c]fluoren-7-yl] 2-methylprop-2-enoate?
The canonical SMILES for (11-cyclopentylbenzo[a]fluoren-11-yl) 2-methylprop-2-enoate;(11-cyclopentylbenzo[b]fluoren-11-yl) 2-methylprop-2-enoate;(7-ethenylbenzo[c]fluoren-7-yl) 2-methylprop-2-enoate;(11-ethynylbenzo[a]fluoren-11-yl) 2-methylprop-2-enoate;(11-ethynylbenzo[b]fluoren-11-yl) 2-methylprop-2-enoate;(7-ethynylbenzo[c]fluoren-7-yl) 2-methylprop-2-enoate;[11-[(E)-prop-1-enyl]benzo[a]fluoren-11-yl] 2-methylprop-2-enoate;[11-[(E)-prop-1-enyl]benzo[b]fluoren-11-yl] 2-methylprop-2-enoate;[7-[(E)-prop-1-enyl]benzo[c]fluoren-7-yl] 2-methylprop-2-enoate is C#CC1(OC(=O)C(=C)C)c2ccccc2-c2c1ccc1ccccc21.C#CC1(OC(=O)C(=C)C)c2ccccc2-c2cc3ccccc3cc21.C#CC1(OC(=O)C(=C)C)c2ccccc2-c2ccc3ccccc3c21.C=C(C)C(=O)OC1(/C=C/C)c2ccccc2-c2c1ccc1ccccc21.C=C(C)C(=O)OC1(/C=C/C)c2ccccc2-c2cc3ccccc3cc21.C=C(C)C(=O)OC1(/C=C/C)c2ccccc2-c2ccc3ccccc3c21.C=C(C)C(=O)OC1(C2CCCC2)c2ccccc2-c2cc3ccccc3cc21.C=C(C)C(=O)OC1(C2CCCC2)c2ccccc2-c2ccc3ccccc3c21.C=CC1(OC(=O)C(=C)C)c2ccccc2-c2c1ccc1ccccc21.
What is the InChIKey of (11-cyclopentylbenzo[a]fluoren-11-yl) 2-methylprop-2-enoate;(11-cyclopentylbenzo[b]fluoren-11-yl) 2-methylprop-2-enoate;(7-ethenylbenzo[c]fluoren-7-yl) 2-methylprop-2-enoate;(11-ethynylbenzo[a]fluoren-11-yl) 2-methylprop-2-enoate;(11-ethynylbenzo[b]fluoren-11-yl) 2-methylprop-2-enoate;(7-ethynylbenzo[c]fluoren-7-yl) 2-methylprop-2-enoate;[11-[(E)-prop-1-enyl]benzo[a]fluoren-11-yl] 2-methylprop-2-enoate;[11-[(E)-prop-1-enyl]benzo[b]fluoren-11-yl] 2-methylprop-2-enoate;[7-[(E)-prop-1-enyl]benzo[c]fluoren-7-yl] 2-methylprop-2-enoate?
The InChIKey is KDQTWBYRJOCXKR-QWCBFFIGSA-N. The full InChI is InChI=1S/2C26H24O2.3C24H20O2.2C23H16O2.C23H18O2.C23H16O2/c1-17(2)25(27)28-26(19-10-4-5-11-19)23-14-8-7-13-21(23)22-16-15-18-9-3-6-12-20(18)24(22)26;1-17(2)25(27)28-26(20-11-5-6-12-20)23-14-8-7-13-21(23)22-15-18-9-3-4-10-19(18)16-24(22)26;1-4-15-24(26-23(25)16(2)3)21-12-8-7-11-19(21)20-14-13-17-9-5-6-10-18(17)22(20)24;1-4-15-24(26-23(25)16(2)3)20-12-8-7-11-19(20)22-18-10-6-5-9-17(18)13-14-21(22)24;1-4-13-24(26-23(25)16(2)3)21-12-8-7-11-19(21)20-14-17-9-5-6-10-18(17)15-22(20)24;1-4-23(25-22(24)15(2)3)20-12-8-7-11-18(20)19-13-16-9-5-6-10-17(16)14-21(19)23;1-4-23(25-22(24)15(2)3)20-12-8-7-11-18(20)19-14-13-16-9-5-6-10-17(16)21(19)23;2*1-4-23(25-22(24)15(2)3)19-12-8-7-11-18(19)21-17-10-6-5-9-16(17)13-14-20(21)23/h3,6-9,12-16,19H,1,4-5,10-11H2,2H3;3-4,7-10,13-16,20H,1,5-6,11-12H2,2H3;3*4-15H,2H2,1,3H3;2*1,5-14H,2H2,3H3;4-14H,1-2H2,3H3;1,5-14H,2H2,3H3/b;;2*15-4+;13-4+;;;;.
What are the key properties of (11-cyclopentylbenzo[a]fluoren-11-yl) 2-methylprop-2-enoate;(11-cyclopentylbenzo[b]fluoren-11-yl) 2-methylprop-2-enoate;(7-ethenylbenzo[c]fluoren-7-yl) 2-methylprop-2-enoate;(11-ethynylbenzo[a]fluoren-11-yl) 2-methylprop-2-enoate;(11-ethynylbenzo[b]fluoren-11-yl) 2-methylprop-2-enoate;(7-ethynylbenzo[c]fluoren-7-yl) 2-methylprop-2-enoate;[11-[(E)-prop-1-enyl]benzo[a]fluoren-11-yl] 2-methylprop-2-enoate;[11-[(E)-prop-1-enyl]benzo[b]fluoren-11-yl] 2-methylprop-2-enoate;[7-[(E)-prop-1-enyl]benzo[c]fluoren-7-yl] 2-methylprop-2-enoate?
(11-cyclopentylbenzo[a]fluoren-11-yl) 2-methylprop-2-enoate;(11-cyclopentylbenzo[b]fluoren-11-yl) 2-methylprop-2-enoate;(7-ethenylbenzo[c]fluoren-7-yl) 2-methylprop-2-enoate;(11-ethynylbenzo[a]fluoren-11-yl) 2-methylprop-2-enoate;(11-ethynylbenzo[b]fluoren-11-yl) 2-methylprop-2-enoate;(7-ethynylbenzo[c]fluoren-7-yl) 2-methylprop-2-enoate;[11-[(E)-prop-1-enyl]benzo[a]fluoren-11-yl] 2-methylprop-2-enoate;[11-[(E)-prop-1-enyl]benzo[b]fluoren-11-yl] 2-methylprop-2-enoate;[7-[(E)-prop-1-enyl]benzo[c]fluoren-7-yl] 2-methylprop-2-enoate has a molecular weight of 3057.75 g/mol, XLogP of 49.84, 24 rotatable bonds, 0 hydrogen bond donors, and 18 hydrogen bond acceptors.
Where does this data come from?
All data for (11-cyclopentylbenzo[a]fluoren-11-yl) 2-methylprop-2-enoate;(11-cyclopentylbenzo[b]fluoren-11-yl) 2-methylprop-2-enoate;(7-ethenylbenzo[c]fluoren-7-yl) 2-methylprop-2-enoate;(11-ethynylbenzo[a]fluoren-11-yl) 2-methylprop-2-enoate;(11-ethynylbenzo[b]fluoren-11-yl) 2-methylprop-2-enoate;(7-ethynylbenzo[c]fluoren-7-yl) 2-methylprop-2-enoate;[11-[(E)-prop-1-enyl]benzo[a]fluoren-11-yl] 2-methylprop-2-enoate;[11-[(E)-prop-1-enyl]benzo[b]fluoren-11-yl] 2-methylprop-2-enoate;[7-[(E)-prop-1-enyl]benzo[c]fluoren-7-yl] 2-methylprop-2-enoate is sourced from PubChem (CID 159104116), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).