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82079-45-6

82079-45-6 | Potassium (S)-oxirane-2-carboxylate

CAS No: 82079-45-6 Catalog No: AG0038F0 MDL No:MFCD00274195

Product Description

Catalog Number:
AG0038F0
Chemical Name:
Potassium (S)-oxirane-2-carboxylate
CAS Number:
82079-45-6
Molecular Formula:
C3H3KO3
Molecular Weight:
126.1524
MDL Number:
MFCD00274195
IUPAC Name:
potassium;(2S)-oxirane-2-carboxylate
InChI:
InChI=1S/C3H4O3.K/c4-3(5)2-1-6-2;/h2H,1H2,(H,4,5);/q;+1/p-1/t2-;/m0./s1
InChI Key:
CMQCDPNYSJUSEH-DKWTVANSSA-M
SMILES:
[O-]C(=O)[C@@H]1CO1.[K+]

Properties

Complexity:
82.2  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
125.972g/mol
Formal Charge:
0
Heavy Atom Count:
7  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
126.152g/mol
Monoisotopic Mass:
125.972g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
52.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

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