(2-tert-butylphenyl)-phenylmethanol

C17H20O — CID 19438357

IUPAC(2-tert-butylphenyl)-phenylmethanol
SMILESCC(C)(C)c1ccccc1C(O)c1ccccc1
InChIInChI=1S/C17H20O/c1-17(2,3)15-12-8-7-11-14(15)16(18)13-9-5-4-6-10-13/h4-12,16,18H,1-3H3
InChIKeyXCUKTYMVQZTCHX-UHFFFAOYSA-N
MW240.35 g/mol
LogP4.07
Rot. Bonds2

About (2-tert-butylphenyl)-phenylmethanol

(2-tert-butylphenyl)-phenylmethanol (PubChem CID 19438357) has the molecular formula C17H20O and a molecular weight of 240.35 g/mol. Its IUPAC name is (2-tert-butylphenyl)-phenylmethanol.

Molecular Properties

Compound Name(2-tert-butylphenyl)-phenylmethanol
PubChem CID19438357
Molecular FormulaC17H20O
Molecular Weight240.35 g/mol
Exact Mass240.15
IUPAC Name(2-tert-butylphenyl)-phenylmethanol
SMILESCC(C)(C)c1ccccc1C(O)c1ccccc1
InChIInChI=1S/C17H20O/c1-17(2,3)15-12-8-7-11-14(15)16(18)13-9-5-4-6-10-13/h4-12,16,18H,1-3H3
InChIKeyXCUKTYMVQZTCHX-UHFFFAOYSA-N
XLogP4.07
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 54.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(2-tert-butylphenyl)-[3-[(2-tert-butylphenyl)-hydroxymethyl]phenyl]methanol
CID 170551631
(R)-[2-[(S)-hydroxy(phenyl)methyl]phenyl]-phenylmethanol
CID 92542463
(2-tert-butylphenyl)-(2-chlorophenyl)methanol
CID 114980515
2-amino-1-(2-tert-butylphenyl)ethanol
CID 18627964
5-[(2-tert-butylphenyl)-hydroxymethyl]furan-2-carboxylic acid
CID 106947428
(5-tert-butyl-2-methoxyphenyl)-phenylmethanol
CID 171366960
(2-tert-butylphenyl)-(5-chloro-2-methoxyphenyl)methanol
CID 104546182
(2-tert-butylphenyl)-(4-methyl-3-pyridinyl)methanol
CID 115817782
(2-tert-butylphenyl)-(2-chloro-4,5-dimethylphenyl)methanol
CID 115484576
(S)-[2-fluoro-3-(trifluoromethyl)phenyl]-phenylmethanol
CID 162539234
1-(2-tert-butylphenyl)-5-methylhexan-1-ol
CID 115829952
4-(2-tert-butylphenyl)-N,N-dimethyl-4-phenylbutan-1-amine
CID 23276099

Frequently Asked Questions

What is the IUPAC name of (2-tert-butylphenyl)-phenylmethanol?
The IUPAC name of (2-tert-butylphenyl)-phenylmethanol (CID 19438357) is (2-tert-butylphenyl)-phenylmethanol.
What is the SMILES notation for (2-tert-butylphenyl)-phenylmethanol?
The canonical SMILES for (2-tert-butylphenyl)-phenylmethanol is CC(C)(C)c1ccccc1C(O)c1ccccc1.
What is the InChIKey of (2-tert-butylphenyl)-phenylmethanol?
The InChIKey is XCUKTYMVQZTCHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20O/c1-17(2,3)15-12-8-7-11-14(15)16(18)13-9-5-4-6-10-13/h4-12,16,18H,1-3H3.
What are the key properties of (2-tert-butylphenyl)-phenylmethanol?
(2-tert-butylphenyl)-phenylmethanol has a molecular weight of 240.35 g/mol, XLogP of 4.07, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2-tert-butylphenyl)-phenylmethanol is sourced from PubChem (CID 19438357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).