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101080-58-4 | Benzamide, 2-chloro-6-methyl-
CAS No: 101080-58-4 Catalog No: AG0003OK MDL No:MFCD00052820
Product Description
Catalog Number:
AG0003OK
Chemical Name:
Benzamide, 2-chloro-6-methyl-
CAS Number:
101080-58-4
Molecular Formula:
C8H8ClNO
Molecular Weight:
169.6082
MDL Number:
MFCD00052820
IUPAC Name:
2-chloro-6-methylbenzamide
InChI:
InChI=1S/C8H8ClNO/c1-5-3-2-4-6(9)7(5)8(10)11/h2-4H,1H3,(H2,10,11)
InChI Key:
ODGRDDQOHGVCHQ-UHFFFAOYSA-N
SMILES:
NC(=O)c1c(C)cccc1Cl
Properties
Complexity:
160
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
169.029g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
169.608g/mol
Monoisotopic Mass:
169.029g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
43.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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