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873972-81-7 | Butanamide,N-[(acetylamino)carbonyl]-
CAS No: 873972-81-7 Catalog No: AG004GPE MDL No:MFCD16878786
Product Description
Catalog Number:
AG004GPE
Chemical Name:
Butanamide,N-[(acetylamino)carbonyl]-
CAS Number:
873972-81-7
Molecular Formula:
C7H12N2O3
Molecular Weight:
172.1818
MDL Number:
MFCD16878786
IUPAC Name:
N-(acetylcarbamoyl)butanamide
InChI:
InChI=1S/C7H12N2O3/c1-3-4-6(11)9-7(12)8-5(2)10/h3-4H2,1-2H3,(H2,8,9,10,11,12)
InChI Key:
AGFANEASZMIBNE-UHFFFAOYSA-N
SMILES:
CCCC(=O)NC(=O)NC(=O)C
Properties
Complexity:
201
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
172.085g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
172.184g/mol
Monoisotopic Mass:
172.085g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
75.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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