AG01EPY3

Name: Sodium 4-Phenylbutyrate-d11
Brand: Angene Chemical
SKU: AG01EPY3

1392208-11-5 | Sodium 4-Phenylbutyrate-d11

AG01EPY3

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CAS Number	1392208-11-5
Catalog Number	AG01EPY3(AGN-PC-3H474H)
Chemical Name	Sodium 4-Phenylbutyrate-d11
IUPAC Name	sodium;2,2,3,3,4,4-hexadeuterio-4-(2,3,4,5,6-pentadeuteriophenyl)butanoate
InChI	InChI=1S/C10H12O2.Na/c11-10(12)8-4-7-9-5-2-1-3-6-9;/h1-3,5-6H,4,7-8H2,(H,11,12);/q;+1/p-1/i1D,2D,3D,4D2,5D,6D,7D2,8D2;
InChI Key	VPZRWNZGLKXFOE-HSYGEVHBSA-M
MDL Number	MFCD30742904
Molecular Formula	C10D11NaO2
Molecular Weight	197.2507
SMILES	[2H]C1=C([2H])C([2H])=C([2H])C([2H])=C1C([2H])([2H])C([2H])([2H])C([2H])([2H])C([O-])=O.[Na+]
Synonyms	benzene-d5-butanoic-d6acid,monosodiumsalt, 1392208-11-5,

Complexity	142
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	197.135g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	11
Molecular Weight	197.253g/mol
Monoisotopic Mass	197.135g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	40.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

CERTIFICATE OF ANALYSIS

Analysis Data:

Test:

Result:

Conclusion: The above product meets the specifications of Angene.

Analyst:Chase

Date:

Reviewed by:Jessie

Date:

Angene International Limited