2,3-Dimethyl-p-anisaldehyde

HCID 596058

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Basic information

CAS: 38998-17-3
Standard SMILES: COc1ccc(C=O)c(C)c1C
InChIKey: MAFDJCNDRCNZFM-UHFFFAOYSA-N
Molecular formula: C10H12O2
Average molar mass: 164.204 g/mol
Monoisotopic mass: 164.08372962

Names & identifiers

Preferred name: 2,3-Dimethyl-p-anisaldehyde
IUPAC: 4-Methoxy-2,3-dimethylbenzaldehyde
English name: 2,3-Dimethylanisaldehyde
Molecular formula: C10H12O2
Molecular weight: 164.2

Names & synonyms

4-METHOXY-2,3-DIMETHYLBENZALDEHYDE2,3-DIMETHYL-ANISALDEHYD2,3-Dimethylanisaldehyde2,3-DIMETHYL-P-ANISALDEHYDE2,3-dimethyl-para-anisaldehyde2,3-DIMETHYL-4-METHOXY-BENZALDEHYDEBenzaldehyde, 4-methoxy-2,3-dimethyl-2,3-DiMethyl-4-Methoxybenzaldehyde 99%4-METHOXY-2,3-DIMETHYLBENZALDEHYDE 95%

Database identifiers

CAS: 38998-17-3
PubChem CID: 596058
DTXSID: DTXSID80192275
EC Number: 254-241-3
Nikkaji: J319.886C

Properties

Physicochemical properties

Melting point: 52 · 52-55 °C(lit.)
Boiling point: 149 · 149-151 °C(Press: 12 Torr)
Density: 1.041 · 1.041±0.06 g/cm3(Predicted)
Flash point: 230 °F · >230 °F
storage temp.: 2 · under inert gas (nitrogen or Argon) at 2-8°C
form: solid
Appearance: Off-white to light yellow Solid
BRN: 1943017 · 1943017
InChI: 1S/C10H12O2/c1-7-8(2)10(12-3)5-4-9(7)6-11/h4-6H,1-3H3
InChIKey: MAFDJCNDRCNZFM-UHFFFAOYSA-N
SMILES: [H]C(=O)c1ccc(OC)c(C)c1C
CAS DataBase Reference: 38998 · 38998-17-3(CAS DataBase Reference)
UNSPSC Code: 12352100 · 12352100
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 302 · H302-H315-H319-H335
Precautionary statements: 261 · P261-P301+P312-P302+P352-P304+P340-P305+P351+P338
PPE: 95 · Eyeshields, Gloves, type N95 (US)
Safety Statements: 22 · 22-24/25
WGK Germany: 3 · 3
HS Code: 2912490090 · 2912490090
Storage Class: 13 · 13 - Non Combustible Solids