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1354010-52-8 | N-[(S)-1-(2-Chloro-acetyl)-pyrrolidin-3-yl]-acetamide
CAS No: 1354010-52-8 Catalog No: AG01F89U MDL No:
Product Description
Catalog Number:
AG01F89U
Chemical Name:
N-[(S)-1-(2-Chloro-acetyl)-pyrrolidin-3-yl]-acetamide
CAS Number:
1354010-52-8
Molecular Formula:
C8H13ClN2O2
Molecular Weight:
204.6540
IUPAC Name:
N-[(3S)-1-(2-chloroacetyl)pyrrolidin-3-yl]acetamide
InChI:
InChI=1S/C8H13ClN2O2/c1-6(12)10-7-2-3-11(5-7)8(13)4-9/h7H,2-5H2,1H3,(H,10,12)/t7-/m0/s1
InChI Key:
ISIKZYXUXLMZLU-ZETCQYMHSA-N
SMILES:
ClCC(=O)N1CC[C@@H](C1)NC(=O)C
Properties
Complexity:
220
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
204.067g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
204.654g/mol
Monoisotopic Mass:
204.067g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
49.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1
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