AG01CCGT

Name: Methyl Paraben-13C6
Brand: Angene Chemical
SKU: AG01CCGT

1581694-95-2 | Methyl Paraben-13C6

AG01CCGT

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CAS Number	1581694-95-2
Catalog Number	AG01CCGT(AGN-PC-0WH4DM)
Chemical Name	Methyl Paraben-13C6
IUPAC Name	methyl 4-hydroxy(1,2,3,4,5,6-13C6)cyclohexa-1,3,5-triene-1-carboxylate
InChI	InChI=1S/C8H8O3/c1-11-8(10)6-2-4-7(9)5-3-6/h2-5,9H,1H3/i2+1,3+1,4+1,5+1,6+1,7+1
InChI Key	LXCFILQKKLGQFO-WBJZHHNVSA-N
MDL Number	MFCD16652565
Molecular Formula	C8H8O3
Molecular Weight	158.1032
SMILES	C(OC)(=O)[13C]1=[13CH][13CH]=[13C](O)[13CH]=[13CH]1
Synonyms	1581694-95-2, methyl 4-hydroxy(13C6)benzoate, DTXSID30894090, Methyl 4-hydroxybenzoate-(ring-13C6), PESTANAL(R), analytical standard, Methyl 4-hydroxybenzoate, Methyl Paraben-13C6 (in Acetone),

Complexity	136
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	158.067473g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	6
Molecular Weight	158.1g/mol
Monoisotopic Mass	158.067473g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	46.5Å²
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2

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