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Sodium Formate-1-13C

CAT: 0572-TRC-S629003-1GSize: 1 gDry Ice: NoHazardous: No
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CAT#:0572-TRC-S629003-1GSize:1 g
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
23102-86-5
Synonyms
sodium;oxo(1^{13}C)methanolate
Hazard Statement
No Data Available
Smiles
[Na+].[O-][13CH]=O
Molecular Formula
13C H O2 . Na
Molecular Weight
69
InChI
InChI=1S/CH2O2.Na/c2-1-3;/h1H,(H,2,3);/q;+1/p-1/i1+1;
Additionnal Information
IUPAC name: sodium;oxo(1^{13}C)methanolate
Shipping Conditions
Room Temperature
Storage Conditions
+4°C

Chemical Information

Sodium formate-13C
CAS Number23102-86-5
PubChem CID16211807
IUPAC Namesodium oxo(113C)methanolate
Molecular FormulaCHNaO2
Molecular Weight69.000
Topological Polar Surface Area40.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Heavy Atom Count4
Formal Charge0
Complexity13
SMILES
[13CH](=O)[O-].[Na+]
InChI
InChI=1S/CH2O2.Na/c2-1-3;/h1H,(H,2,3);/q;+1/p-1/i1+1;
InChIKey
HLBBKKJFGFRGMU-YTBWXGASSA-M
Chemical Structure
2D Structure
2D structure of Sodium formate-13C
CAS: 23102-86-5
CID: 16211807
Formula: CHNaO2
MW: 69.000
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight69.000
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Exact Mass68.99077839
Monoisotopic Mass68.99077839
Topological Polar Surface Area40.1 Ų
Heavy Atom Count4
Formal Charge0
Complexity13.5
Isotope Atom Count1
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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