2-benzhydryl-6-methylphenol

C20H18O — CID 154120751

IUPAC2-benzhydryl-6-methylphenol
SMILESCc1cccc(C(c2ccccc2)c2ccccc2)c1O
InChIInChI=1S/C20H18O/c1-15-9-8-14-18(20(15)21)19(16-10-4-2-5-11-16)17-12-6-3-7-13-17/h2-14,19,21H,1H3
InChIKeyBSCVIQQCUKWTJW-UHFFFAOYSA-N
MW274.36 g/mol
LogP4.88
Rot. Bonds3

About 2-benzhydryl-6-methylphenol

2-benzhydryl-6-methylphenol (PubChem CID 154120751) has the molecular formula C20H18O and a molecular weight of 274.36 g/mol. Its IUPAC name is 2-benzhydryl-6-methylphenol.

Molecular Properties

Compound Name2-benzhydryl-6-methylphenol
PubChem CID154120751
Molecular FormulaC20H18O
Molecular Weight274.36 g/mol
Exact Mass274.14
IUPAC Name2-benzhydryl-6-methylphenol
SMILESCc1cccc(C(c2ccccc2)c2ccccc2)c1O
InChIInChI=1S/C20H18O/c1-15-9-8-14-18(20(15)21)19(16-10-4-2-5-11-16)17-12-6-3-7-13-17/h2-14,19,21H,1H3
InChIKeyBSCVIQQCUKWTJW-UHFFFAOYSA-N
XLogP4.88
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.36
LogP ≤ 54.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

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Related Compounds

2-[(2-hydroxy-3-methylphenyl)-(2-hydroxyphenyl)methyl]-6-methylphenol
CID 141022269
2-methyl-6-(1-phenylpropyl)phenol
CID 123572881
3-benzhydryl-2-hydroxybenzoic acid;zinc
CID 70592549
[(3S)-3-(2-hydroxy-3-methylphenyl)-3-phenylpropyl]-methyl-di(propan-2-yl)azanium
CID 20774440
2-[(1S)-1,2-diaminoethyl]-6-methylphenol;hydrochloride
CID 171212487
2-[1-(2-hydroxy-3-methylphenyl)undecyl]-6-methylphenol
CID 135345596
2-[(1R,2R)-1-amino-2-hydroxypropyl]-6-methylphenol
CID 131181882
2-[(1R)-1-amino-2,2-dimethylpropyl]-6-methylphenol
CID 130731500
2-[(3,7-dimethyl-1H-indol-2-yl)-phenylmethyl]phenol
CID 132583305
(3S)-3-amino-3-(2-hydroxy-3-methylphenyl)propanenitrile
CID 130632734
(2-bromo-3-methylphenyl)-phenylmethanol
CID 107983305
2-[hydroxy(phenyl)methyl]-3-methylphenol
CID 54494463

Frequently Asked Questions

What is the IUPAC name of 2-benzhydryl-6-methylphenol?
The IUPAC name of 2-benzhydryl-6-methylphenol (CID 154120751) is 2-benzhydryl-6-methylphenol.
What is the SMILES notation for 2-benzhydryl-6-methylphenol?
The canonical SMILES for 2-benzhydryl-6-methylphenol is Cc1cccc(C(c2ccccc2)c2ccccc2)c1O.
What is the InChIKey of 2-benzhydryl-6-methylphenol?
The InChIKey is BSCVIQQCUKWTJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18O/c1-15-9-8-14-18(20(15)21)19(16-10-4-2-5-11-16)17-12-6-3-7-13-17/h2-14,19,21H,1H3.
What are the key properties of 2-benzhydryl-6-methylphenol?
2-benzhydryl-6-methylphenol has a molecular weight of 274.36 g/mol, XLogP of 4.88, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-benzhydryl-6-methylphenol is sourced from PubChem (CID 154120751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).