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Acetyl -2-13C chloride

CAT: 0024-sc-227208Size: 250 mgDry Ice: NoHazardous: No
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CAT#:0024-sc-227208Size:250 mg
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CAS Number
14770-40-2

Chemical Information

Acetyl-2-13C chloride
CAS Number14770-40-2
PubChem CID12214086
IUPAC Nameacetyl chloride
Molecular FormulaC2H3ClO
Molecular Weight79.49
XLogP0.8
Topological Polar Surface Area17.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Heavy Atom Count4
Formal Charge0
Complexity33
SMILES
[13CH3]C(=O)Cl
InChI
InChI=1S/C2H3ClO/c1-2(3)4/h1H3/i1+1
InChIKey
WETWJCDKMRHUPV-OUBTZVSYSA-N
Chemical Structure
2D Structure
2D structure of Acetyl-2-13C chloride
CAS: 14770-40-2
CID: 12214086
Formula: C2H3ClO
MW: 79.49
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight79.49
XLogP30.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Exact Mass78.9905972
Monoisotopic Mass78.9905972
Topological Polar Surface Area17.1 Ų
Heavy Atom Count4
Formal Charge0
Complexity33
Isotope Atom Count1
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
440854-01Acetyl-2-13C Chloride
C3631702-Chloro-acetyl-2-13C Chloride
440833-01Acetyl Chloride-1-13C
TRC-A464971-100MGAcetyl-13C,d3 Chloride
289826-01Thiophene-2-acetyl chloride
OR1004082-012- (Chlorophenoxy) acetyl chloride
PC1003736-01(2-Fluorophenoxy) acetyl chloride
AR-A02611-012-Thiophene Acetyl Chloride
FN121016-01(2-Naphthyloxy) acetyl chloride
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