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119003-02-0 | 2-Propenamide, N-[3-[(2-chloroacetyl)amino]propyl]-2-methyl-
CAS No: 119003-02-0 Catalog No: AG000P1C MDL No:
Product Description
Catalog Number:
AG000P1C
Chemical Name:
2-Propenamide, N-[3-[(2-chloroacetyl)amino]propyl]-2-methyl-
CAS Number:
119003-02-0
Molecular Formula:
C9H15ClN2O2
Molecular Weight:
218.6806
IUPAC Name:
N-[3-[(2-chloroacetyl)amino]propyl]-2-methylprop-2-enamide
InChI:
InChI=1S/C9H15ClN2O2/c1-7(2)9(14)12-5-3-4-11-8(13)6-10/h1,3-6H2,2H3,(H,11,13)(H,12,14)
InChI Key:
VOQACZADDJDTOD-UHFFFAOYSA-N
SMILES:
ClCC(=O)NCCCNC(=O)C(=C)C
Properties
Complexity:
229
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
218.082g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
218.681g/mol
Monoisotopic Mass:
218.082g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
58.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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