1,1,2,2,3,3-hexamethyl-5-[2-[(4-methylphenyl)methyl]phenyl]indene

C29H34 — CID 147159492

IUPAC1,1,2,2,3,3-hexamethyl-5-[2-[(4-methylphenyl)methyl]phenyl]indene
SMILESCc1ccc(Cc2ccccc2-c2ccc3c(c2)C(C)(C)C(C)(C)C3(C)C)cc1
InChIInChI=1S/C29H34/c1-20-12-14-21(15-13-20)18-22-10-8-9-11-24(22)23-16-17-25-26(19-23)28(4,5)29(6,7)27(25,2)3/h8-17,19H,18H2,1-7H3
InChIKeyBVNZQKOUNWTZOC-UHFFFAOYSA-N
MW382.59 g/mol
LogP7.85
Rot. Bonds3

About 1,1,2,2,3,3-hexamethyl-5-[2-[(4-methylphenyl)methyl]phenyl]indene

1,1,2,2,3,3-hexamethyl-5-[2-[(4-methylphenyl)methyl]phenyl]indene (PubChem CID 147159492) has the molecular formula C29H34 and a molecular weight of 382.59 g/mol. Its IUPAC name is 1,1,2,2,3,3-hexamethyl-5-[2-[(4-methylphenyl)methyl]phenyl]indene.

Molecular Properties

Compound Name1,1,2,2,3,3-hexamethyl-5-[2-[(4-methylphenyl)methyl]phenyl]indene
PubChem CID147159492
Molecular FormulaC29H34
Molecular Weight382.59 g/mol
Exact Mass382.27
IUPAC Name1,1,2,2,3,3-hexamethyl-5-[2-[(4-methylphenyl)methyl]phenyl]indene
SMILESCc1ccc(Cc2ccccc2-c2ccc3c(c2)C(C)(C)C(C)(C)C3(C)C)cc1
InChIInChI=1S/C29H34/c1-20-12-14-21(15-13-20)18-22-10-8-9-11-24(22)23-16-17-25-26(19-23)28(4,5)29(6,7)27(25,2)3/h8-17,19H,18H2,1-7H3
InChIKeyBVNZQKOUNWTZOC-UHFFFAOYSA-N
XLogP7.85
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500382.59
LogP ≤ 57.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

2-(1,1,2,2,3,3-hexamethylinden-5-yl)aniline
CID 154982020
N-[[2-(1,1,2,2,3,3-hexamethylinden-5-yl)phenyl]methyl]-7,9,9-trimethyl-N-(3-methylphenyl)fluoren-2-amine
CID 154592851
3-(1,1,2,2,3,3-hexamethylinden-5-yl)-4-methyl-N,N-diphenylaniline
CID 142500857
5-[2-(3,5-dimethylphenyl)-3-[6-(1,1,2,2,3,3-hexamethylinden-5-yl)-3-pyridinyl]phenyl]-2-(1,1,2,2,3,3-hexamethylinden-5-yl)pyridine
CID 153422803
4-(1,1,2,2,3,3-hexamethylinden-5-yl)-2-[4-[2-[3-methyl-5-[1,1,2,2-tetradeuterio-2-(4-pyridin-2-ylphenyl)ethyl]phenyl]phenyl]phenyl]pyridine
CID 169048458
1-N,4-N-bis(1,1,2,2,3,3-hexamethylinden-5-yl)-1-N,4-N-bis(4-methylphenyl)benzene-1,4-diamine
CID 142500399
9,9-dimethyl-1-[(4-phenylphenyl)methyl]fluorene
CID 144558289
2-[2-[(4-chlorophenyl)methyl]phenyl]-1,4-dimethylbenzene
CID 174900515
2-benzyl-4-[6-(1,1,2,2,3,3-hexamethylinden-5-yl)-3-pyridinyl]-6-methyl-1,3,5-triazine
CID 130376249
2-[6-(1,1,2,2,3,3-hexamethylinden-5-yl)-3-pyridinyl]-4-(2-methylphenyl)-6-phenyl-1,3,5-triazine
CID 118857536
1-methyl-4-[[2-[[2-[(4-methylphenyl)methyl]phenyl]methoxymethyl]phenyl]methyl]benzene
CID 67814336
1-methyl-4-[2-(nitrosomethyl)phenyl]benzene
CID 54442957

Frequently Asked Questions

What is the IUPAC name of 1,1,2,2,3,3-hexamethyl-5-[2-[(4-methylphenyl)methyl]phenyl]indene?
The IUPAC name of 1,1,2,2,3,3-hexamethyl-5-[2-[(4-methylphenyl)methyl]phenyl]indene (CID 147159492) is 1,1,2,2,3,3-hexamethyl-5-[2-[(4-methylphenyl)methyl]phenyl]indene.
What is the SMILES notation for 1,1,2,2,3,3-hexamethyl-5-[2-[(4-methylphenyl)methyl]phenyl]indene?
The canonical SMILES for 1,1,2,2,3,3-hexamethyl-5-[2-[(4-methylphenyl)methyl]phenyl]indene is Cc1ccc(Cc2ccccc2-c2ccc3c(c2)C(C)(C)C(C)(C)C3(C)C)cc1.
What is the InChIKey of 1,1,2,2,3,3-hexamethyl-5-[2-[(4-methylphenyl)methyl]phenyl]indene?
The InChIKey is BVNZQKOUNWTZOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H34/c1-20-12-14-21(15-13-20)18-22-10-8-9-11-24(22)23-16-17-25-26(19-23)28(4,5)29(6,7)27(25,2)3/h8-17,19H,18H2,1-7H3.
What are the key properties of 1,1,2,2,3,3-hexamethyl-5-[2-[(4-methylphenyl)methyl]phenyl]indene?
1,1,2,2,3,3-hexamethyl-5-[2-[(4-methylphenyl)methyl]phenyl]indene has a molecular weight of 382.59 g/mol, XLogP of 7.85, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,2,2,3,3-hexamethyl-5-[2-[(4-methylphenyl)methyl]phenyl]indene is sourced from PubChem (CID 147159492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).