CAS 18370-11-1 N-Methyl-p-toluamide (HCID 140377)

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Basic information

CAS: 18370-11-1
Standard SMILES: CNC(=O)c1ccc(C)cc1
InChIKey: FZIOOTTWDRFBKU-UHFFFAOYSA-N
Molecular formula: C9H11NO
Average molar mass: 149.19 g/mol
Monoisotopic mass: 149.08406397

Names & identifiers

Preferred name: N-Methyl-p-toluamide
IUPAC: N,4-dimethylbenzamide
English name: N-Methyl-p-toluamide
Molecular formula: C9H11NO
Molecular weight: 149.19

Names & synonyms

N-Methyl-p-toluamide18370-11-1DTXSID40171465RefChem:1091939DTXCID2093956N,4-Dimethylbenzamide4,n-dimethyl-benzamideN-Methyl-4-methylbenzamideMFCD00043627N-methyl(4-methylphenyl)carboxamideN,P-DIMETHYLBENZAMIDEp-Dimethylbenzamide

Show more names

TIMTEC-BB SBB008263N-Methyl-4-methylbenzamide,97%N-Methyl-4-MethylbenzaMide, 97%

Benzamide, N,4-dimethyl- (9CI)N-methyl-4-toluamideN,4-dimethyl-benzamideN,4-Dimethylbenzamide #4-methyl-N-methylbenzamideBenzamide, N,4-dimethyl-N-Methyl 4-methylbenzamideSCHEMBL131434

Database identifiers

CAS: 18370-11-1
PubChem CID: 140377
DTXSID: DTXSID40171465
EC Number: 140-974-5
Nikkaji: J484.226J

Properties

Computed structural properties

XLogP: 1.2
Topological polar surface area: 29.1 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 1
Rotatable bonds: 1
Heavy atoms: 11
Formal charge: 0
Complexity: 136

Physicochemical properties

Melting point: 143 · 143-145 °C(Solv: ethyl ether (60-29-7))
Boiling point: 293.2 · 293.2±19.0 °C(Predicted)
Density: 1.021 · 1.021±0.06 g/cm3(Predicted)
pka: 15.25 · 15.25±0.46(Predicted)
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 315 · H315-H319-H335
Precautionary statements: 261 · P261-P280a-P304+P340-P305+P351+P338-P405-P501a