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Sodium chloroacetate

CAT: 0063-42830696-500gSize: 500 gDry Ice: NoHazardous: No
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CAT#:0063-42830696-500gSize:500 g
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CAS Number
3926-62-3
Molecular Formula
C2H2ClNaO2
Molecular Weight
116.48
Formulation
C2H2ClNaO2

Chemical Information

Sodium chloroacetate

Sodium chloroacetate is a white colored powdered solid. It is soluble in water. It may be toxic ingestion or inhalation. It is used to make weed killers, dyes and pharmaceuticals.

CAS Number3926-62-3
PubChem CID23665759
IUPAC Namesodium 2-chloroacetate
Molecular FormulaC2H2ClNaO2
Molecular Weight116.48
Topological Polar Surface Area40.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Heavy Atom Count6
Formal Charge0
Complexity46
SMILES
C(C(=O)[O-])Cl.[Na+]
InChI
InChI=1S/C2H3ClO2.Na/c3-1-2(4)5;/h1H2,(H,4,5);/q;+1/p-1
InChIKey
FDRCDNZGSXJAFP-UHFFFAOYSA-M
Chemical Structure
2D Structure
2D structure of Sodium chloroacetate
CAS: 3926-62-3
CID: 23665759
Formula: C2H2ClNaO2
MW: 116.48
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight116.48
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Exact Mass115.9641013
Monoisotopic Mass115.9641013
Topological Polar Surface Area40.1 Ų
Heavy Atom Count6
Formal Charge0
Complexity46.8
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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