2',3,3'-tris(ethenyl)-5-methyl-2-[(Z)-prop-1-enyl]-1,1'-spirobi[indene]

C27H24 — CID 145301502

IUPAC2',3,3'-tris(ethenyl)-5-methyl-2-[(Z)-prop-1-enyl]-1,1'-spirobi[indene]
SMILESC=CC1=C(C=C)C2(C(/C=C\C)=C(C=C)c3cc(C)ccc32)c2ccccc21
InChIInChI=1S/C27H24/c1-6-12-24-20(8-3)22-17-18(5)15-16-26(22)27(24)23(9-4)19(7-2)21-13-10-11-14-25(21)27/h6-17H,2-4H2,1,5H3/b12-6-
InChIKeyRSFRTAIASDMANX-SDQBBNPISA-N
MW348.49 g/mol
LogP6.95
Rot. Bonds4

About 2',3,3'-tris(ethenyl)-5-methyl-2-[(Z)-prop-1-enyl]-1,1'-spirobi[indene]

2',3,3'-tris(ethenyl)-5-methyl-2-[(Z)-prop-1-enyl]-1,1'-spirobi[indene] (PubChem CID 145301502) has the molecular formula C27H24 and a molecular weight of 348.49 g/mol. Its IUPAC name is 2',3,3'-tris(ethenyl)-5-methyl-2-[(Z)-prop-1-enyl]-1,1'-spirobi[indene].

Molecular Properties

Compound Name2',3,3'-tris(ethenyl)-5-methyl-2-[(Z)-prop-1-enyl]-1,1'-spirobi[indene]
PubChem CID145301502
Molecular FormulaC27H24
Molecular Weight348.49 g/mol
Exact Mass348.19
IUPAC Name2',3,3'-tris(ethenyl)-5-methyl-2-[(Z)-prop-1-enyl]-1,1'-spirobi[indene]
SMILESC=CC1=C(C=C)C2(C(/C=C\C)=C(C=C)c3cc(C)ccc32)c2ccccc21
InChIInChI=1S/C27H24/c1-6-12-24-20(8-3)22-17-18(5)15-16-26(22)27(24)23(9-4)19(7-2)21-13-10-11-14-25(21)27/h6-17H,2-4H2,1,5H3/b12-6-
InChIKeyRSFRTAIASDMANX-SDQBBNPISA-N
XLogP6.95
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500348.49
LogP ≤ 56.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

3'-ethenyl-2-methyl-2'-[(Z)-prop-1-enyl]spiro[fluorene-9,1'-indene]
CID 144911605
3,3'-bis(ethenyl)-2,2'-bis[(Z)-prop-1-enyl]-1,1'-spirobi[indene]
CID 145204058
2',3'-bis(ethenyl)-2-methylspiro[fluorene-9,1'-indene];ethane;methane
CID 163299187
1,2'-bis[(1Z)-buta-1,3-dienyl]-2,3'-bis(ethenyl)-3-methyl-4-[(Z)-prop-1-enyl]spiro[cyclopenta-1,3-diene-5,1'-indene]
CID 174069889
(2E,3Z)-3'-ethenyl-2-ethylidene-6'-methyl-2'-[(Z)-prop-1-enyl]-3-propylidene-1,1'-spirobi[indene]
CID 144569336
2',3'-bis(ethenyl)-2-(4-methylphenyl)spiro[fluorene-9,1'-indene];methane
CID 143486387
3'-ethenyl-5-methyl-2'-[(Z)-prop-1-enyl]spiro[hexacyclo[12.11.0.02,7.08,13.015,24.018,23]pentacosa-1(14),2(7),3,5,8,10,12,15(24),16,18,20,22-dodecaene-25,1'-indene]
CID 145353205
2-[(1Z)-buta-1,3-dienyl]-2'-ethenyl-3-methyl-3'-[(Z)-prop-1-enyl]-1,1'-spirobi[indene]
CID 142597844
acetylene;1-ethenyl-2,3-dimethyl-4-[(Z)-prop-1-enyl]spiro[cyclopenta-1,3-diene-5,9'-fluorene];methane;prop-1-ene
CID 145096318
3'-ethenyl-2'-[(Z)-prop-1-enyl]spiro[cyclopentane-1,1'-indene]
CID 143984015
2',3'-bis(ethenyl)-5'-(4-methylnaphthalen-1-yl)spiro[fluorene-9,1'-indene]
CID 156896762
N-[1-ethenyl-3,3-diphenyl-2-[(Z)-prop-1-enyl]inden-5-yl]-N-naphthalen-2-yl-9,9-diphenylfluoren-3-amine
CID 134491053

Frequently Asked Questions

What is the IUPAC name of 2',3,3'-tris(ethenyl)-5-methyl-2-[(Z)-prop-1-enyl]-1,1'-spirobi[indene]?
The IUPAC name of 2',3,3'-tris(ethenyl)-5-methyl-2-[(Z)-prop-1-enyl]-1,1'-spirobi[indene] (CID 145301502) is 2',3,3'-tris(ethenyl)-5-methyl-2-[(Z)-prop-1-enyl]-1,1'-spirobi[indene].
What is the SMILES notation for 2',3,3'-tris(ethenyl)-5-methyl-2-[(Z)-prop-1-enyl]-1,1'-spirobi[indene]?
The canonical SMILES for 2',3,3'-tris(ethenyl)-5-methyl-2-[(Z)-prop-1-enyl]-1,1'-spirobi[indene] is C=CC1=C(C=C)C2(C(/C=C\C)=C(C=C)c3cc(C)ccc32)c2ccccc21.
What is the InChIKey of 2',3,3'-tris(ethenyl)-5-methyl-2-[(Z)-prop-1-enyl]-1,1'-spirobi[indene]?
The InChIKey is RSFRTAIASDMANX-SDQBBNPISA-N. The full InChI is InChI=1S/C27H24/c1-6-12-24-20(8-3)22-17-18(5)15-16-26(22)27(24)23(9-4)19(7-2)21-13-10-11-14-25(21)27/h6-17H,2-4H2,1,5H3/b12-6-.
What are the key properties of 2',3,3'-tris(ethenyl)-5-methyl-2-[(Z)-prop-1-enyl]-1,1'-spirobi[indene]?
2',3,3'-tris(ethenyl)-5-methyl-2-[(Z)-prop-1-enyl]-1,1'-spirobi[indene] has a molecular weight of 348.49 g/mol, XLogP of 6.95, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2',3,3'-tris(ethenyl)-5-methyl-2-[(Z)-prop-1-enyl]-1,1'-spirobi[indene] is sourced from PubChem (CID 145301502), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).