3,3'-Biphenyldiol

C₁₂H₁₀O₂CAS 612-76-0186.21 g/mol

Open in Covalent MOL file

Phenol

Properties

Molecular formula: C₁₂H₁₀O₂
Molar mass: 186.21 g/mol
Exact mass: 186.0681 Da
logP: 2.76Crippen estimate
Polar surface area: 40.5 Å²
H-bond donors / acceptors: 2 / 2
Rotatable bonds: 1

Hazards

Danger

H302 Harmful if swallowed100% of notifiers
H315 Causes skin irritation100% of notifiers
H318 Causes serious eye damage100% of notifiers
H335 May cause respiratory irritation100% of notifiers

Aggregated from 39 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

612-76-0

SMILES

C1=CC(=CC(=C1)O)C2=CC(=CC=C2)O

InChIKey

VZQSBJKDSWXLKX-UHFFFAOYSA-N

InChI

InChI=1S/C12H10O2/c13-11-5-1-3-9(7-11)10-4-2-6-12(14)8-10/h1-8,13-14H

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

14 names · show all

3-(3-Hydroxyphenyl)phenol
[1,1'-Biphenyl]-3,3'-diol
3,3'-Dihydroxybiphenyl
m,m'-Biphenol
3,3'-Biphenol
[1,1'-Biphenyl]diol
(1,1'-Biphenyl)-3,3'-diol
(1,1'-Biphenyl)diol
(1,1'-Biphenyl)-ar,3-diol
[1,1'-Biphenyl]-ar,3-diol
Biphenyl-3,3'-diol
(1P)-[1,1'-Biphenyl]-3,3'-diol
3,3'-Dihydroxydiphenyl
3,3 Inverted exclamation marka-Dihydroxybiphenyl

Reactions

3,3'-Dihydroxybiphenyl (m,m'-Biphenol)product

Work with 3,3'-Biphenyldiol

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

3-Phenylphenol580-51-884 % similar Resorcinol108-46-371 % similar 3-Chlorophenol108-43-055 % similar 3-Fluorophenol372-20-355 % similar M-Cresol108-39-452 % similar 3-[(3-Hydroxyphenyl)disulfanyl]phenol21101-56-452 % similar 3-Hydroxybenzenethiol40248-84-852 % similar 3-Bromophenol591-20-852 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

Phenylhydroquinone1079-21-6 2-Naphthyl acetate1523-11-1 4-Methoxy-1-naphthaldehyde15971-29-6 (1,1'-Biphenyl)-2,2'-diol1806-29-7 1,4-Benzenedicarboxaldehyd2065232-74-6 Methyl 2-naphthoate2459-25-8 6-Methoxy-2-naphthaldehyde3453-33-6 4-Methyl-1-naphthoic acid4488-40-8

Elsewhere

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