Home Halogens 2-chloro-N-(2-cyano-2-methylethyl)-N-ethylacetamide

2-chloro-N-(2-cyano-2-methylethyl)-N-ethylacetamide

CAS No.:
1184272-17-0
Catalog Number:
AG019VPR
Molecular Formula:
C8H13ClN2O
Molecular Weight:
188.6546
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Product Description
Catalog Number:
AG019VPR
Chemical Name:
2-chloro-N-(2-cyano-2-methylethyl)-N-ethylacetamide
CAS Number:
1184272-17-0
Molecular Formula:
C8H13ClN2O
Molecular Weight:
188.6546
MDL Number:
MFCD12798924
IUPAC Name:
2-chloro-N-(2-cyanopropyl)-N-ethylacetamide
InChI:
InChI=1S/C8H13ClN2O/c1-3-11(8(12)4-9)6-7(2)5-10/h7H,3-4,6H2,1-2H3
InChI Key:
TVVPJGXZGOPTSI-UHFFFAOYSA-N
SMILES:
N#CC(CN(C(=O)CCl)CC)C
Properties
Complexity:
197  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.072g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
188.655g/mol
Monoisotopic Mass:
188.072g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
44.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1  
Properties