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125639-92-1 | 2-Azetidinecarboxylic acid, 3-ethyl-4-oxo-, methyl ester, (2R,3R)-rel-
CAS No: 125639-92-1 Catalog No: AG000O8N MDL No:
Product Description
Catalog Number:
AG000O8N
Chemical Name:
2-Azetidinecarboxylic acid, 3-ethyl-4-oxo-, methyl ester, (2R,3R)-rel-
CAS Number:
125639-92-1
Molecular Formula:
C7H11NO3
Molecular Weight:
157.1671
IUPAC Name:
methyl 3-ethyl-4-oxoazetidine-2-carboxylate
InChI:
InChI=1S/C7H11NO3/c1-3-4-5(7(10)11-2)8-6(4)9/h4-5H,3H2,1-2H3,(H,8,9)
InChI Key:
VNMPZKJTANRMRB-UHFFFAOYSA-N
SMILES:
CC[C@H]1C(=O)N[C@H]1C(=O)OC
Properties
Complexity:
190
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
157.074g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
157.169g/mol
Monoisotopic Mass:
157.074g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
55.4A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1
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