273244
3′-Methylacetanilide
98%
Synonym(s):
m-Acetotoluidide
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About This Item
Linear Formula:
CH3CONHC6H4CH3
CAS Number:
Molecular Weight:
149.19
EC Number:
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22
vapor pressure
16 mmHg ( 163 °C)
Assay
98%
bp
303 °C (lit.)
mp
65-67 °C (lit.)
solubility
alcohol: freely soluble(lit.)
diethyl ether: freely soluble(lit.)
water: slightly soluble(lit.)
SMILES string
CC(=O)Nc1cccc(C)c1
InChI
1S/C9H11NO/c1-7-4-3-5-9(6-7)10-8(2)11/h3-6H,1-2H3,(H,10,11)
InChI key
ALMHSXDYCFOZQD-UHFFFAOYSA-N
General description
The IR spectra and the structural data of 3′-methylacetanilide was studied.
Signal Word
Warning
Hazard Statements
Precautionary Statements
Hazard Classifications
Acute Tox. 4 Oral - Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3
Target Organs
Respiratory system
Storage Class Code
11 - Combustible Solids
WGK
WGK 3
Flash Point(F)
Not applicable
Flash Point(C)
Not applicable
Personal Protective Equipment
dust mask type N95 (US), Eyeshields, Gloves
Regulatory Information
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Wioleta Rmiszek-Lindert et al.
Acta crystallographica. Section C, Crystal structure communications, 64(Pt 11), o599-o603 (2008-11-08)
Molecules of the title compounds, 3'-methylacetanilide [or N-(m-tolyl)acetamide], C(9)H(11)NO, (I), and N-benzylthioacetamide, C(9)H(11)NS, (II), are connected by a framework of intermolecular N-H...O and N-H...S hydrogen bonds, respectively, forming chains with the graph-set description C(4), which run along the b axis.
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