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15029-36-4 | Acetamide, 2-cyano-N-ethyl-
CAS No: 15029-36-4 Catalog No: AG001MHG MDL No:MFCD00118415
Product Description
Catalog Number:
AG001MHG
Chemical Name:
Acetamide, 2-cyano-N-ethyl-
CAS Number:
15029-36-4
Molecular Formula:
C5H8N2O
Molecular Weight:
112.1298
MDL Number:
MFCD00118415
IUPAC Name:
2-cyano-N-ethylacetamide
InChI:
InChI=1S/C5H8N2O/c1-2-7-5(8)3-4-6/h2-3H2,1H3,(H,7,8)
InChI Key:
VARXTXAOJGBDDV-UHFFFAOYSA-N
SMILES:
CCNC(=O)CC#N
NSC Number:
112760
Properties
Complexity:
122
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
112.064g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
112.132g/mol
Monoisotopic Mass:
112.064g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
52.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2
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