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102613-32-1 | Heptanamide, N-(aminocarbonyl)-2-ethylidene-
CAS No: 102613-32-1 Catalog No: AG0007Y5 MDL No:
Product Description
Catalog Number:
AG0007Y5
Chemical Name:
Heptanamide, N-(aminocarbonyl)-2-ethylidene-
CAS Number:
102613-32-1
Molecular Formula:
C10H18N2O2
Molecular Weight:
198.2621
IUPAC Name:
N-carbamoyl-2-ethylideneheptanamide
InChI:
InChI=1S/C10H18N2O2/c1-3-5-6-7-8(4-2)9(13)12-10(11)14/h4H,3,5-7H2,1-2H3,(H3,11,12,13,14)
InChI Key:
GZXQVLMVKMXPRH-UHFFFAOYSA-N
SMILES:
CC=C(C(=O)NC(=O)N)CCCCC
Properties
Complexity:
234
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
198.137g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
198.266g/mol
Monoisotopic Mass:
198.137g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
72.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
2.6
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