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79353-58-5 | 1-Azetidinepropanoic acid, 2-oxo-, methyl ester
CAS No: 79353-58-5 Catalog No: AG005KAF MDL No:
Product Description
Catalog Number:
AG005KAF
Chemical Name:
1-Azetidinepropanoic acid, 2-oxo-, methyl ester
CAS Number:
79353-58-5
Molecular Formula:
C7H11NO3
Molecular Weight:
157.1671
IUPAC Name:
methyl 3-(2-oxoazetidin-1-yl)propanoate
InChI:
InChI=1S/C7H11NO3/c1-11-7(10)3-5-8-4-2-6(8)9/h2-5H2,1H3
InChI Key:
RGGKEIBJIXUMHO-UHFFFAOYSA-N
SMILES:
COC(=O)CCN1CCC1=O
Properties
Complexity:
179
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:
0
Isotope Atom Count:
0
Molecular Weight:
157.169g/mol
Monoisotopic Mass:
157.074g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
46.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.7
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