4',10'-dimethylspiro[12H-benzo[a]anthracene-7,7'-benzo[c]fluorene];9,9'-dimethylspiro[12H-benzo[a]anthracene-7,7'-benzo[c]fluorene];10,10'-dimethylspiro[12H-benzo[a]anthracene-7,7'-benzo[c]fluorene];2',8'-dimethylspiro[5H-tetracene-12,11'-benzo[b]fluorene]

C144H104 — CID 157460289

IUPAC4',10'-dimethylspiro[12H-benzo[a]anthracene-7,7'-benzo[c]fluorene];9,9'-dimethylspiro[12H-benzo[a]anthracene-7,7'-benzo[c]fluorene];10,10'-dimethylspiro[12H-benzo[a]anthracene-7,7'-benzo[c]fluorene];2',8'-dimethylspiro[5H-tetracene-12,11'-benzo[b]fluorene]
SMILESCc1ccc2c(c1)-c1c(ccc3c(C)cccc13)C21c2ccccc2Cc2c1ccc1ccccc21.Cc1ccc2c(c1)C1(c3cc(C)ccc3-c3c1ccc1ccccc31)c1ccc3ccccc3c1C2.Cc1ccc2c(c1)C1(c3ccccc3Cc3cc4ccccc4cc31)c1cc3cc(C)ccc3cc1-2.Cc1ccc2c(c1)Cc1c(ccc3ccccc13)C21c2ccc(C)cc2-c2c1ccc1ccccc21
InChIInChI=1S/4C36H26/c1-22-14-17-33-30(20-22)35-28-12-7-8-23(2)26(28)16-19-34(35)36(33)31-13-6-4-10-25(31)21-29-27-11-5-3-9-24(27)15-18-32(29)36;1-22-11-15-31-26(19-22)21-29-27-9-5-3-7-24(27)13-17-32(29)36(31)33-16-12-23(2)20-30(33)35-28-10-6-4-8-25(28)14-18-34(35)36;1-22-11-13-26-21-30-27-9-5-3-7-24(27)14-17-31(30)36(33(26)19-22)32-18-15-25-8-4-6-10-28(25)35(32)29-16-12-23(2)20-34(29)36;1-22-11-13-26-19-31-30-14-12-23(2)16-34(30)36(35(31)21-28(26)15-22)32-10-6-5-9-27(32)18-29-17-24-7-3-4-8-25(24)20-33(29)36/h3*3-20H,21H2,1-2H3;3-17,19-21H,18H2,1-2H3
InChIKeyBTVMNVNSSFTLTO-UHFFFAOYSA-N
MW1834.42 g/mol
LogP35.51
Rot. Bonds

About 4',10'-dimethylspiro[12H-benzo[a]anthracene-7,7'-benzo[c]fluorene];9,9'-dimethylspiro[12H-benzo[a]anthracene-7,7'-benzo[c]fluorene];10,10'-dimethylspiro[12H-benzo[a]anthracene-7,7'-benzo[c]fluorene];2',8'-dimethylspiro[5H-tetracene-12,11'-benzo[b]fluorene]

4',10'-dimethylspiro[12H-benzo[a]anthracene-7,7'-benzo[c]fluorene];9,9'-dimethylspiro[12H-benzo[a]anthracene-7,7'-benzo[c]fluorene];10,10'-dimethylspiro[12H-benzo[a]anthracene-7,7'-benzo[c]fluorene];2',8'-dimethylspiro[5H-tetracene-12,11'-benzo[b]fluorene] (PubChem CID 157460289) has the molecular formula C144H104 and a molecular weight of 1834.42 g/mol. Its IUPAC name is 4',10'-dimethylspiro[12H-benzo[a]anthracene-7,7'-benzo[c]fluorene];9,9'-dimethylspiro[12H-benzo[a]anthracene-7,7'-benzo[c]fluorene];10,10'-dimethylspiro[12H-benzo[a]anthracene-7,7'-benzo[c]fluorene];2',8'-dimethylspiro[5H-tetracene-12,11'-benzo[b]fluorene].

Molecular Properties

Compound Name4',10'-dimethylspiro[12H-benzo[a]anthracene-7,7'-benzo[c]fluorene];9,9'-dimethylspiro[12H-benzo[a]anthracene-7,7'-benzo[c]fluorene];10,10'-dimethylspiro[12H-benzo[a]anthracene-7,7'-benzo[c]fluorene];2',8'-dimethylspiro[5H-tetracene-12,11'-benzo[b]fluorene]
PubChem CID157460289
Molecular FormulaC144H104
Molecular Weight1834.42 g/mol
Exact Mass1832.81
IUPAC Name4',10'-dimethylspiro[12H-benzo[a]anthracene-7,7'-benzo[c]fluorene];9,9'-dimethylspiro[12H-benzo[a]anthracene-7,7'-benzo[c]fluorene];10,10'-dimethylspiro[12H-benzo[a]anthracene-7,7'-benzo[c]fluorene];2',8'-dimethylspiro[5H-tetracene-12,11'-benzo[b]fluorene]
SMILESCc1ccc2c(c1)-c1c(ccc3c(C)cccc13)C21c2ccccc2Cc2c1ccc1ccccc21.Cc1ccc2c(c1)C1(c3cc(C)ccc3-c3c1ccc1ccccc31)c1ccc3ccccc3c1C2.Cc1ccc2c(c1)C1(c3ccccc3Cc3cc4ccccc4cc31)c1cc3cc(C)ccc3cc1-2.Cc1ccc2c(c1)Cc1c(ccc3ccccc13)C21c2ccc(C)cc2-c2c1ccc1ccccc21
InChIInChI=1S/4C36H26/c1-22-14-17-33-30(20-22)35-28-12-7-8-23(2)26(28)16-19-34(35)36(33)31-13-6-4-10-25(31)21-29-27-11-5-3-9-24(27)15-18-32(29)36;1-22-11-15-31-26(19-22)21-29-27-9-5-3-7-24(27)13-17-32(29)36(31)33-16-12-23(2)20-30(33)35-28-10-6-4-8-25(28)14-18-34(35)36;1-22-11-13-26-21-30-27-9-5-3-7-24(27)14-17-31(30)36(33(26)19-22)32-18-15-25-8-4-6-10-28(25)35(32)29-16-12-23(2)20-34(29)36;1-22-11-13-26-19-31-30-14-12-23(2)16-34(30)36(35(31)21-28(26)15-22)32-10-6-5-9-27(32)18-29-17-24-7-3-4-8-25(24)20-33(29)36/h3*3-20H,21H2,1-2H3;3-17,19-21H,18H2,1-2H3
InChIKeyBTVMNVNSSFTLTO-UHFFFAOYSA-N
XLogP35.51
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms144
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001834.42
LogP ≤ 535.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 4',10'-dimethylspiro[12H-benzo[a]anthracene-7,7'-benzo[c]fluorene];9,9'-dimethylspiro[12H-benzo[a]anthracene-7,7'-benzo[c]fluorene];10,10'-dimethylspiro[12H-benzo[a]anthracene-7,7'-benzo[c]fluorene];2',8'-dimethylspiro[5H-tetracene-12,11'-benzo[b]fluorene] with MolForge

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Related Compounds

3'-methylspiro[9H-anthracene-10,11'-benzo[b]fluorene]
CID 142293757
4,5-dimethyl-9H-fluorene;2,2'-dimethyl-9,9'-spirobi[fluorene];2',7'-dimethyl-9,9'-spirobi[fluorene];3,3'-dimethyl-9,9'-spirobi[fluorene];3,6-dimethyl-9,9'-spirobi[fluorene];ethane
CID 161481336
CID 142294433
CID 142294433
1',8'-dimethylspiro[9H-anthracene-10,9'-fluorene];2',7'-dimethylspiro[9H-anthracene-10,9'-fluorene];3',6'-dimethylspiro[9H-anthracene-10,9'-fluorene];4',5'-dimethylspiro[9H-anthracene-10,9'-fluorene];4,5-dimethylspiro[9H-anthracene-10,9'-fluorene];ethane
CID 160522820
11H-benzo[a]fluorene;ethane;3-methyl-11H-benzo[a]fluorene;2-methyl-11H-benzo[b]fluorene;8-methyl-11H-benzo[b]fluorene;5-methyl-7H-benzo[c]fluorene;19-methylhexacyclo[11.11.0.02,11.03,8.015,23.016,21]tetracosa-1(24),2(11),3,5,7,9,13,15(23),16(21),17,19-undecaene
CID 157095898
N-(4-methylphenyl)-N-spiro[fluorene-9,12'-pentacyclo[11.8.0.02,11.03,8.015,20]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene]-17'-ylspiro[fluorene-9,12'-pentacyclo[11.8.0.02,11.03,8.015,20]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene]-17'-amine
CID 137494242
N-(2,5-dimethylphenyl)-N-(4-methylphenyl)spiro[fluorene-9,12'-pentacyclo[11.8.0.02,11.03,8.015,20]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene]-17'-amine
CID 137494940
4'-methylspiro[benzo[c]fluorene-7,9'-fluorene]
CID 140792308
N-(9H-fluoren-2-yl)-N-(spiro[benzo[b]fluorene-11,9'-fluorene]-4'-ylmethyl)-9H-fluoren-2-amine;N-(9H-fluoren-2-yl)-N-(spiro[benzo[b]fluorene-11,9'-fluorene]-4'-ylmethyl)-9H-fluoren-3-amine;N-(9H-fluoren-1-yl)-N-(spiro[benzo[c]fluorene-7,9'-fluorene]-4'-ylmethyl)-9H-fluoren-2-amine
CID 157131998
ethane;2-methylprop-2-enylideneazanide;9-methylspiro[benzo[a]fluorene-11,9'-fluorene];2-methylspiro[benzo[b]fluorene-11,9'-fluorene];9-methylspiro[benzo[c]fluorene-7,9'-fluorene];(yttrium)
CID 161073358
3'-(9H-fluoren-4-yl)spiro[benzo[c]fluorene-7,9'-fluorene]
CID 158727165
2-methyl-9,9'-spirobi[fluorene];bis(4'-methyl-9,9'-spirobi[fluorene])
CID 158761183

Frequently Asked Questions

What is the IUPAC name of 4',10'-dimethylspiro[12H-benzo[a]anthracene-7,7'-benzo[c]fluorene];9,9'-dimethylspiro[12H-benzo[a]anthracene-7,7'-benzo[c]fluorene];10,10'-dimethylspiro[12H-benzo[a]anthracene-7,7'-benzo[c]fluorene];2',8'-dimethylspiro[5H-tetracene-12,11'-benzo[b]fluorene]?
The IUPAC name of 4',10'-dimethylspiro[12H-benzo[a]anthracene-7,7'-benzo[c]fluorene];9,9'-dimethylspiro[12H-benzo[a]anthracene-7,7'-benzo[c]fluorene];10,10'-dimethylspiro[12H-benzo[a]anthracene-7,7'-benzo[c]fluorene];2',8'-dimethylspiro[5H-tetracene-12,11'-benzo[b]fluorene] (CID 157460289) is 4',10'-dimethylspiro[12H-benzo[a]anthracene-7,7'-benzo[c]fluorene];9,9'-dimethylspiro[12H-benzo[a]anthracene-7,7'-benzo[c]fluorene];10,10'-dimethylspiro[12H-benzo[a]anthracene-7,7'-benzo[c]fluorene];2',8'-dimethylspiro[5H-tetracene-12,11'-benzo[b]fluorene].
What is the SMILES notation for 4',10'-dimethylspiro[12H-benzo[a]anthracene-7,7'-benzo[c]fluorene];9,9'-dimethylspiro[12H-benzo[a]anthracene-7,7'-benzo[c]fluorene];10,10'-dimethylspiro[12H-benzo[a]anthracene-7,7'-benzo[c]fluorene];2',8'-dimethylspiro[5H-tetracene-12,11'-benzo[b]fluorene]?
The canonical SMILES for 4',10'-dimethylspiro[12H-benzo[a]anthracene-7,7'-benzo[c]fluorene];9,9'-dimethylspiro[12H-benzo[a]anthracene-7,7'-benzo[c]fluorene];10,10'-dimethylspiro[12H-benzo[a]anthracene-7,7'-benzo[c]fluorene];2',8'-dimethylspiro[5H-tetracene-12,11'-benzo[b]fluorene] is Cc1ccc2c(c1)-c1c(ccc3c(C)cccc13)C21c2ccccc2Cc2c1ccc1ccccc21.Cc1ccc2c(c1)C1(c3cc(C)ccc3-c3c1ccc1ccccc31)c1ccc3ccccc3c1C2.Cc1ccc2c(c1)C1(c3ccccc3Cc3cc4ccccc4cc31)c1cc3cc(C)ccc3cc1-2.Cc1ccc2c(c1)Cc1c(ccc3ccccc13)C21c2ccc(C)cc2-c2c1ccc1ccccc21.
What is the InChIKey of 4',10'-dimethylspiro[12H-benzo[a]anthracene-7,7'-benzo[c]fluorene];9,9'-dimethylspiro[12H-benzo[a]anthracene-7,7'-benzo[c]fluorene];10,10'-dimethylspiro[12H-benzo[a]anthracene-7,7'-benzo[c]fluorene];2',8'-dimethylspiro[5H-tetracene-12,11'-benzo[b]fluorene]?
The InChIKey is BTVMNVNSSFTLTO-UHFFFAOYSA-N. The full InChI is InChI=1S/4C36H26/c1-22-14-17-33-30(20-22)35-28-12-7-8-23(2)26(28)16-19-34(35)36(33)31-13-6-4-10-25(31)21-29-27-11-5-3-9-24(27)15-18-32(29)36;1-22-11-15-31-26(19-22)21-29-27-9-5-3-7-24(27)13-17-32(29)36(31)33-16-12-23(2)20-30(33)35-28-10-6-4-8-25(28)14-18-34(35)36;1-22-11-13-26-21-30-27-9-5-3-7-24(27)14-17-31(30)36(33(26)19-22)32-18-15-25-8-4-6-10-28(25)35(32)29-16-12-23(2)20-34(29)36;1-22-11-13-26-19-31-30-14-12-23(2)16-34(30)36(35(31)21-28(26)15-22)32-10-6-5-9-27(32)18-29-17-24-7-3-4-8-25(24)20-33(29)36/h3*3-20H,21H2,1-2H3;3-17,19-21H,18H2,1-2H3.
What are the key properties of 4',10'-dimethylspiro[12H-benzo[a]anthracene-7,7'-benzo[c]fluorene];9,9'-dimethylspiro[12H-benzo[a]anthracene-7,7'-benzo[c]fluorene];10,10'-dimethylspiro[12H-benzo[a]anthracene-7,7'-benzo[c]fluorene];2',8'-dimethylspiro[5H-tetracene-12,11'-benzo[b]fluorene]?
4',10'-dimethylspiro[12H-benzo[a]anthracene-7,7'-benzo[c]fluorene];9,9'-dimethylspiro[12H-benzo[a]anthracene-7,7'-benzo[c]fluorene];10,10'-dimethylspiro[12H-benzo[a]anthracene-7,7'-benzo[c]fluorene];2',8'-dimethylspiro[5H-tetracene-12,11'-benzo[b]fluorene] has a molecular weight of 1834.42 g/mol, XLogP of 35.51, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 4',10'-dimethylspiro[12H-benzo[a]anthracene-7,7'-benzo[c]fluorene];9,9'-dimethylspiro[12H-benzo[a]anthracene-7,7'-benzo[c]fluorene];10,10'-dimethylspiro[12H-benzo[a]anthracene-7,7'-benzo[c]fluorene];2',8'-dimethylspiro[5H-tetracene-12,11'-benzo[b]fluorene] is sourced from PubChem (CID 157460289), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).