2,3-Dimethylbenzamide

CAT: 0024-sc-275284Size: 1 gDry Ice: NoHazardous: No

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CAT#:0024-sc-275284Size:1 g

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CAS Number

5580-34-7

Chemical Information

2,3-Dimethylbenzamide

2,3-Dimethylbenzamide is a methylbenzene.

CAS Number	5580-34-7
PubChem CID	2800987
IUPAC Name	2,3-dimethylbenzamide
Molecular Formula	C9H11NO
Molecular Weight	149.19
XLogP	1.1
Topological Polar Surface Area	43.1
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	1
Heavy Atom Count	11
Formal Charge	0
Complexity	156

SMILES

CC1=C(C(=CC=C1)C(=O)N)C

InChI

InChI=1S/C9H11NO/c1-6-4-3-5-8(7(6)2)9(10)11/h3-5H,1-2H3,(H2,10,11)

InChIKey

IZAYISYTIWLBNB-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 5580-34-7

CID: 2800987

Formula: C9H11NO

MW: 149.19

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	149.19
XLogP3	1.1
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	1
Exact Mass	149.084063974
Monoisotopic Mass	149.084063974
Topological Polar Surface Area	43.1 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	156
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
sc-346452	3-amino-N,2-dimethylbenzamide
sc-346452A	3-amino-N,2-dimethylbenzamide
sc-276483	3,4-Dimethylbenzamide
sc-310444	3-[ (2-Bromoacetyl) amino]-N, N-dimethylbenzamide
sc-342767A	2-hydroxy-3-methoxy-N, N-dimethylbenzamide
sc-342767	2-hydroxy-3-methoxy-N, N-dimethylbenzamide
sc-306863	2-Amino-N, N-dimethylbenzamide
sc-276035	3-amino-N, N-dimethylbenzamide
sc-344510A	3- (aminomethyl) -N, N-dimethylbenzamide
sc-349182A	4-amino-N,3-dimethylbenzamide

Catalog	Name
FD160849	2,3-Dimethylbenzamide
D37435	2 3-Dimethylbenzamide
OR1096524-01	2-chloro-N,3-dimethylbenzamide
VJB99757	2-Amino-N,3-dimethylbenzamide
PC1021747-01	3-Fluoro-N,2-dimethylbenzamide
OR1086233-01	3-Iodo-N,2-dimethylbenzamide
BMB25413	3-amino-N,2-dimethylbenzamide
OR1088335-01	3-Chloro-2,4-dimethylbenzamide
AR-T02629-01	2,3-Dimethylbenzamide Tolvaptan impurity
OR90930-01	2,4-Dimethylbenzamide