9,9-dimethyl-2,7-bis(5,6,7,8-tetrahydronaphthalen-2-yl)fluorene

C35H34 — CID 59217252

IUPAC9,9-dimethyl-2,7-bis(5,6,7,8-tetrahydronaphthalen-2-yl)fluorene
SMILESCC1(C)c2cc(-c3ccc4c(c3)CCCC4)ccc2-c2ccc(-c3ccc4c(c3)CCCC4)cc21
InChIInChI=1S/C35H34/c1-35(2)33-21-29(27-13-11-23-7-3-5-9-25(23)19-27)15-17-31(33)32-18-16-30(22-34(32)35)28-14-12-24-8-4-6-10-26(24)20-28/h11-22H,3-10H2,1-2H3
InChIKeyYJDBNSBTGYXNNY-UHFFFAOYSA-N
MW454.66 g/mol
LogP9.08
Rot. Bonds2

About 9,9-dimethyl-2,7-bis(5,6,7,8-tetrahydronaphthalen-2-yl)fluorene

9,9-dimethyl-2,7-bis(5,6,7,8-tetrahydronaphthalen-2-yl)fluorene (PubChem CID 59217252) has the molecular formula C35H34 and a molecular weight of 454.66 g/mol. Its IUPAC name is 9,9-dimethyl-2,7-bis(5,6,7,8-tetrahydronaphthalen-2-yl)fluorene.

Molecular Properties

Compound Name9,9-dimethyl-2,7-bis(5,6,7,8-tetrahydronaphthalen-2-yl)fluorene
PubChem CID59217252
Molecular FormulaC35H34
Molecular Weight454.66 g/mol
Exact Mass454.27
IUPAC Name9,9-dimethyl-2,7-bis(5,6,7,8-tetrahydronaphthalen-2-yl)fluorene
SMILESCC1(C)c2cc(-c3ccc4c(c3)CCCC4)ccc2-c2ccc(-c3ccc4c(c3)CCCC4)cc21
InChIInChI=1S/C35H34/c1-35(2)33-21-29(27-13-11-23-7-3-5-9-25(23)19-27)15-17-31(33)32-18-16-30(22-34(32)35)28-14-12-24-8-4-6-10-26(24)20-28/h11-22H,3-10H2,1-2H3
InChIKeyYJDBNSBTGYXNNY-UHFFFAOYSA-N
XLogP9.08
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms35
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500454.66
LogP ≤ 59.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

9,9-dimethyl-2-[4-[(E)-2-naphthalen-2-ylethenyl]phenyl]-7-(5,6,7,8-tetrahydronaphthalen-2-yl)fluorene
CID 59217196
decacyclo[26.11.0.02,14.03,12.05,10.015,27.016,25.018,23.029,38.031,36]nonatriaconta-1(28),2(14),3(12),4,10,15(27),16(25),17,23,29(38),30,36-dodecaene-13,26,39-trione;6,15,24-tris(9,9-dimethyl-7-phenylfluoren-2-yl)heptacyclo[18.7.0.02,10.03,8.011,19.012,17.021,26]heptacosa-1(20),2(10),3(8),4,6,11(19),12(17),13,15,21(26),22,24-dodecaene-9,18,27-trione
CID 158617120
4-[7-(4-hydroxyphenyl)-9,9-dimethylfluoren-2-yl]phenol
CID 18714128
9,9-dimethyl-2,7-bis(2-phenyl-2,3-dihydro-1H-inden-5-yl)fluorene
CID 59217030
N-[2,6-dimethyl-4-(5,6,7,8-tetrahydronaphthalen-2-yl)phenyl]-N-(9,9-diphenylfluoren-2-yl)-9,9-dimethylfluoren-2-amine
CID 155221170
9,9-dimethyl-N-(2-naphthalen-1-ylphenyl)-N-[4-(5,6,7,8-tetrahydronaphthalen-2-yl)phenyl]fluoren-2-amine
CID 170538805
5-(4-methylphenyl)-2,3-dihydro-1H-indene
CID 59217485
2-[3,5-bis[7-[7-[7-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]phenyl]-7-[7-[7-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluorene
CID 101336380
2-(3,5-diphenylphenyl)-7-[4-[7-(3,5-diphenylphenyl)-9,9-dimethylfluoren-2-yl]phenyl]-9,9-dimethylfluorene
CID 58880913
2,7-bis(3,5-diphenylphenyl)-9,9-dimethylfluorene
CID 59217114
2,7-bis[3,5-bis[3,5-bis(9,9-dimethylfluoren-2-yl)phenyl]phenyl]-9,9-dimethylfluorene
CID 58881238
9,9-dimethyl-N-phenyl-N,3-bis(5,6,7,8-tetrahydronaphthalen-2-yl)fluoren-2-amine
CID 170445163

Frequently Asked Questions

What is the IUPAC name of 9,9-dimethyl-2,7-bis(5,6,7,8-tetrahydronaphthalen-2-yl)fluorene?
The IUPAC name of 9,9-dimethyl-2,7-bis(5,6,7,8-tetrahydronaphthalen-2-yl)fluorene (CID 59217252) is 9,9-dimethyl-2,7-bis(5,6,7,8-tetrahydronaphthalen-2-yl)fluorene.
What is the SMILES notation for 9,9-dimethyl-2,7-bis(5,6,7,8-tetrahydronaphthalen-2-yl)fluorene?
The canonical SMILES for 9,9-dimethyl-2,7-bis(5,6,7,8-tetrahydronaphthalen-2-yl)fluorene is CC1(C)c2cc(-c3ccc4c(c3)CCCC4)ccc2-c2ccc(-c3ccc4c(c3)CCCC4)cc21.
What is the InChIKey of 9,9-dimethyl-2,7-bis(5,6,7,8-tetrahydronaphthalen-2-yl)fluorene?
The InChIKey is YJDBNSBTGYXNNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C35H34/c1-35(2)33-21-29(27-13-11-23-7-3-5-9-25(23)19-27)15-17-31(33)32-18-16-30(22-34(32)35)28-14-12-24-8-4-6-10-26(24)20-28/h11-22H,3-10H2,1-2H3.
What are the key properties of 9,9-dimethyl-2,7-bis(5,6,7,8-tetrahydronaphthalen-2-yl)fluorene?
9,9-dimethyl-2,7-bis(5,6,7,8-tetrahydronaphthalen-2-yl)fluorene has a molecular weight of 454.66 g/mol, XLogP of 9.08, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 9,9-dimethyl-2,7-bis(5,6,7,8-tetrahydronaphthalen-2-yl)fluorene is sourced from PubChem (CID 59217252), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).