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21437-81-0 | Propanamide, 3-iodo-
CAS No: 21437-81-0 Catalog No: AG007QJE MDL No:
Product Description
Catalog Number:
AG007QJE
Chemical Name:
Propanamide, 3-iodo-
CAS Number:
21437-81-0
Molecular Formula:
C3H6INO
Molecular Weight:
198.9903
IUPAC Name:
3-iodopropanamide
InChI:
InChI=1S/C3H6INO/c4-2-1-3(5)6/h1-2H2,(H2,5,6)
InChI Key:
WUDXYFDMZPYSAS-UHFFFAOYSA-N
SMILES:
NC(=O)CCI
Properties
Complexity:
54.8
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
198.949g/mol
Formal Charge:
0
Heavy Atom Count:
6
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
198.991g/mol
Monoisotopic Mass:
198.949g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
43.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0
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