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17756-81-9 | Acetamide, 2-chloro-N-(2-cyanoethyl)-
CAS No: 17756-81-9 Catalog No: AG0025E3 MDL No:MFCD01733630
Product Description
Catalog Number:
AG0025E3
Chemical Name:
Acetamide, 2-chloro-N-(2-cyanoethyl)-
CAS Number:
17756-81-9
Molecular Formula:
C5H7ClN2O
Molecular Weight:
146.5749
MDL Number:
MFCD01733630
IUPAC Name:
2-chloro-N-(2-cyanoethyl)acetamide
InChI:
InChI=1S/C5H7ClN2O/c6-4-5(9)8-3-1-2-7/h1,3-4H2,(H,8,9)
InChI Key:
WECIKJKLCDCIMY-UHFFFAOYSA-N
SMILES:
ClCC(=O)NCCC#N
UNII:
0XF1T004AK
Properties
Complexity:
137
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
146.025g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
146.574g/mol
Monoisotopic Mass:
146.025g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
52.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1
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