2,4-Dimethylresorcinol

HCID 69452

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Basic information

CAS: 634-65-1
Standard SMILES: Cc1ccc(O)c(C)c1O
InChIKey: RJWLXGOSIRVRAR-UHFFFAOYSA-N
Molecular formula: C8H10O2
Average molar mass: 138.16 g/mol
Monoisotopic mass: 138.06807956

Names & identifiers

Preferred name: 2,4-Dimethylresorcinol
IUPAC: 2,4-dimethylbenzene-1,3-diol
English name: 2,4-Dimethyl-1,3-benzenediol
Molecular formula: C8H10O2
Molecular weight: 138.16

Names & synonyms

634-65-12,4-DimethylresorcinolEINECS 211-213-5DTXSID60212809RefChem:82553DTXCID40135300211-213-52,4-dimethylbenzene-1,3-diol2,4-Dimethyl-1,3-benzenediolMFCD064108051,3-DIHYDROXY-2,4-DIMETHYLBENZENE2,4-dimethyl-benzene-1,3-diol

Show more names

1,3-Benzenediol, 2,4-dimethyl-Dimethylhydroresorcinm-Xylene-2,4-diolSCHEMBL212872,6-DiMethyl-1,3-benzenediolSCHEMBL27735404SCHEMBL293565242,4-Dimethyl-1,3-dihydroxybenzene

Database identifiers

CAS: 634-65-1
PubChem CID: 69452
DTXSID: DTXSID60212809
EC Number: 211-213-5
Nikkaji: J116.748K

Properties

Computed structural properties

XLogP: 1.9
Topological polar surface area: 40.5 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 2
Rotatable bonds: 0
Heavy atoms: 10
Formal charge: 0
Complexity: 114

Physicochemical properties

Melting point: 110 ℃ · 110℃
Boiling point: 286 ℃ · 286℃
Density: 1.162 · 1.162
Flash point: 142 ℃ · 142℃
storage temp.: Sealed in dry,Room Temperature
pka: 10.42 · 10.42±0.23(Predicted)
Symbol(GHS): 6 · GHS06,GHS08,GHS09
Signal word: Danger
Hazard statements: 301 · H301-H315-H319-H370-H317-H400
Precautionary statements: 273 · P273-P260-P280-P391-P308+P311-P301+P310+P330