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76965-63-4 | Propanoyl chloride, 2-(acetylamino)-, (S)-
CAS No: 76965-63-4 Catalog No: AG01FBF0 MDL No:
Product Description
Catalog Number:
AG01FBF0
Chemical Name:
Propanoyl chloride, 2-(acetylamino)-, (S)-
CAS Number:
76965-63-4
Molecular Formula:
C5H8ClNO2
Molecular Weight:
149.5755
IUPAC Name:
(2S)-2-acetamidopropanoyl chloride
InChI:
InChI=1S/C5H8ClNO2/c1-3(5(6)9)7-4(2)8/h3H,1-2H3,(H,7,8)/t3-/m0/s1
InChI Key:
GPKGJXIWUKAIQA-VKHMYHEASA-N
SMILES:
CC(=O)N[C@H](C(=O)Cl)C
Properties
Complexity:
135
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
149.024g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
149.574g/mol
Monoisotopic Mass:
149.024g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
46.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1
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