(3-methyl-1,1-diphenylbutan-2-yl)benzene

C23H24 — CID 91598963

IUPAC(3-methyl-1,1-diphenylbutan-2-yl)benzene
SMILESCC(C)C(c1ccccc1)C(c1ccccc1)c1ccccc1
InChIInChI=1S/C23H24/c1-18(2)22(19-12-6-3-7-13-19)23(20-14-8-4-9-15-20)21-16-10-5-11-17-21/h3-18,22-23H,1-2H3
InChIKeyAMDCFOPYMQWRFN-UHFFFAOYSA-N
MW300.45 g/mol
LogP6.26
Rot. Bonds5

About (3-methyl-1,1-diphenylbutan-2-yl)benzene

(3-methyl-1,1-diphenylbutan-2-yl)benzene (PubChem CID 91598963) has the molecular formula C23H24 and a molecular weight of 300.45 g/mol. Its IUPAC name is (3-methyl-1,1-diphenylbutan-2-yl)benzene.

Molecular Properties

Compound Name(3-methyl-1,1-diphenylbutan-2-yl)benzene
PubChem CID91598963
Molecular FormulaC23H24
Molecular Weight300.45 g/mol
Exact Mass300.19
IUPAC Name(3-methyl-1,1-diphenylbutan-2-yl)benzene
SMILESCC(C)C(c1ccccc1)C(c1ccccc1)c1ccccc1
InChIInChI=1S/C23H24/c1-18(2)22(19-12-6-3-7-13-19)23(20-14-8-4-9-15-20)21-16-10-5-11-17-21/h3-18,22-23H,1-2H3
InChIKeyAMDCFOPYMQWRFN-UHFFFAOYSA-N
XLogP6.26
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500300.45
LogP ≤ 56.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

(2,6-dimethyl-4-propan-2-ylheptan-3-yl)benzene
CID 140816676
2,3,3-triphenylpropane-1,1-diol
CID 57157507
1,1-diphenylpropan-2-ylbenzene
CID 3664636
dilithium;hydride;(2-methyl-1,3,3-triphenylpropyl)benzene
CID 173113616
4-methyl-2,3-diphenylpentanoic acid
CID 13280236
N-ethyl-3-methyl-1,1-diphenylbutan-2-amine
CID 60817823
1-chloro-4-(2-methyl-1-phenylpropyl)benzene
CID 22890486
benzene;cumene
CID 157215889
propan-2-ylcyclodecapentaene
CID 123508933
1-phenylethylbenzene
CID 11918
1-phenylethylbenzene
CID 142851428
cumene
CID 161227923

Frequently Asked Questions

What is the IUPAC name of (3-methyl-1,1-diphenylbutan-2-yl)benzene?
The IUPAC name of (3-methyl-1,1-diphenylbutan-2-yl)benzene (CID 91598963) is (3-methyl-1,1-diphenylbutan-2-yl)benzene.
What is the SMILES notation for (3-methyl-1,1-diphenylbutan-2-yl)benzene?
The canonical SMILES for (3-methyl-1,1-diphenylbutan-2-yl)benzene is CC(C)C(c1ccccc1)C(c1ccccc1)c1ccccc1.
What is the InChIKey of (3-methyl-1,1-diphenylbutan-2-yl)benzene?
The InChIKey is AMDCFOPYMQWRFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24/c1-18(2)22(19-12-6-3-7-13-19)23(20-14-8-4-9-15-20)21-16-10-5-11-17-21/h3-18,22-23H,1-2H3.
What are the key properties of (3-methyl-1,1-diphenylbutan-2-yl)benzene?
(3-methyl-1,1-diphenylbutan-2-yl)benzene has a molecular weight of 300.45 g/mol, XLogP of 6.26, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (3-methyl-1,1-diphenylbutan-2-yl)benzene is sourced from PubChem (CID 91598963), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).