(6-methyl-4-phenylheptan-2-yl)benzene

C20H26 — CID 174190180

IUPAC(6-methyl-4-phenylheptan-2-yl)benzene
SMILESCC(C)CC(CC(C)c1ccccc1)c1ccccc1
InChIInChI=1S/C20H26/c1-16(2)14-20(19-12-8-5-9-13-19)15-17(3)18-10-6-4-7-11-18/h4-13,16-17,20H,14-15H2,1-3H3
InChIKeyWYIRIDKVSUERCK-UHFFFAOYSA-N
MW266.43 g/mol
LogP6.01
Rot. Bonds6

About (6-methyl-4-phenylheptan-2-yl)benzene

(6-methyl-4-phenylheptan-2-yl)benzene (PubChem CID 174190180) has the molecular formula C20H26 and a molecular weight of 266.43 g/mol. Its IUPAC name is (6-methyl-4-phenylheptan-2-yl)benzene.

Molecular Properties

Compound Name(6-methyl-4-phenylheptan-2-yl)benzene
PubChem CID174190180
Molecular FormulaC20H26
Molecular Weight266.43 g/mol
Exact Mass266.20
IUPAC Name(6-methyl-4-phenylheptan-2-yl)benzene
SMILESCC(C)CC(CC(C)c1ccccc1)c1ccccc1
InChIInChI=1S/C20H26/c1-16(2)14-20(19-12-8-5-9-13-19)15-17(3)18-10-6-4-7-11-18/h4-13,16-17,20H,14-15H2,1-3H3
InChIKeyWYIRIDKVSUERCK-UHFFFAOYSA-N
XLogP6.01
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500266.43
LogP ≤ 56.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

4,7-diphenyloctan-2-ylbenzene
CID 21184937
1-butan-2-yl-4-(4,6-diphenyloctan-2-yl)benzene
CID 23386381
(4R)-2-methyl-6-phenylheptan-4-ol
CID 135043417
1-(2,6-diphenyloctan-4-yl)-4-(3,6-diphenyloctan-4-yl)benzene
CID 143858458
4-(2,6-diphenyloctan-4-yl)pyridine;methane
CID 157478380
magnesium 4-[6-phenyl-4-(4-sulfonatophenyl)octan-2-yl]benzenesulfonate
CID 172972808
1-[4,6-bis(4-methylphenyl)heptan-2-yl]-4-methylbenzene
CID 164713773
4-phenylheptane-2,6-diol
CID 173150769
3-phenylbutane-1,1-diol
CID 18417931
1-bromo-4-[1-[2-(4-butan-2-ylphenyl)propyl]-3-phenylpentyl]benzene
CID 154824840
1-(3,7-diphenylnonan-5-yl)-4-[7-phenyl-1-(2-phenylbutyl)-5-[4-(3-phenylbutyl)phenyl]-3-[4-(2,4,8,10-tetraphenyldodecan-6-yl)phenyl]octyl]benzene
CID 59289101
1-methoxy-4-(4-phenylhexan-2-yl)benzene
CID 134214893

Frequently Asked Questions

What is the IUPAC name of (6-methyl-4-phenylheptan-2-yl)benzene?
The IUPAC name of (6-methyl-4-phenylheptan-2-yl)benzene (CID 174190180) is (6-methyl-4-phenylheptan-2-yl)benzene.
What is the SMILES notation for (6-methyl-4-phenylheptan-2-yl)benzene?
The canonical SMILES for (6-methyl-4-phenylheptan-2-yl)benzene is CC(C)CC(CC(C)c1ccccc1)c1ccccc1.
What is the InChIKey of (6-methyl-4-phenylheptan-2-yl)benzene?
The InChIKey is WYIRIDKVSUERCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26/c1-16(2)14-20(19-12-8-5-9-13-19)15-17(3)18-10-6-4-7-11-18/h4-13,16-17,20H,14-15H2,1-3H3.
What are the key properties of (6-methyl-4-phenylheptan-2-yl)benzene?
(6-methyl-4-phenylheptan-2-yl)benzene has a molecular weight of 266.43 g/mol, XLogP of 6.01, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (6-methyl-4-phenylheptan-2-yl)benzene is sourced from PubChem (CID 174190180), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).