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Sodium Propionate-13C3

CAT: 0572-TRC-S673290-10MGSize: 10 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-S673290-10MGSize:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
152571-51-2
Hazard Statement
Toxic in contact with skin; UN number: UN2811; Packing Group: III
Smiles
[13CH3][13CH2][13C](O[Na])=O
Molecular Formula
13C3H5NaO2
Molecular Weight
99.04
Shipping Conditions
Room Temperature
Storage Conditions
-20°C

Chemical Information

Sodium propionate-13C3
CAS Number152571-51-2
PubChem CID16213474
IUPAC Namesodium (1,2,3-13C3)propanoate
Molecular FormulaC3H5NaO2
Molecular Weight99.039
Topological Polar Surface Area40.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Heavy Atom Count6
Formal Charge0
Complexity44
SMILES
[13CH3][13CH2][13C](=O)[O-].[Na+]
InChI
InChI=1S/C3H6O2.Na/c1-2-3(4)5;/h2H2,1H3,(H,4,5);/q;+1/p-1/i1+1,2+1,3+1;
InChIKey
JXKPEJDQGNYQSM-HCULJTSZSA-M
Chemical Structure
2D Structure
2D structure of Sodium propionate-13C3
CAS: 152571-51-2
CID: 16213474
Formula: C3H5NaO2
MW: 99.039
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight99.039
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Exact Mass99.02878819
Monoisotopic Mass99.02878819
Topological Polar Surface Area40.1 Ų
Heavy Atom Count6
Formal Charge0
Complexity44.1
Isotope Atom Count3
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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HY-B1773AS3Sodium propionate-13C3
sc-251043Sodium propionate
HY-B1773AS-01Sodium propionate-13C
HY-B1773AR-01Sodium propionate (Standard)
466327-01Sodium Propionate Hydrate
LC-10553.1Sodium propionate pure
HY-B1773AS4-01Sodium propionate-d5
DE2155Sodium Propionate-D3
sc-251046Sodium propionate-2-13C
02493 00500Sodium propionate 98% Extrapure

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