AG008BN0

Name: 4,6-Dioxoheptanoic acid-13C5
Brand: Angene Chemical
SKU: AG008BN0

881835-86-5 | 4,6-Dioxoheptanoic acid-13C5

AG008BN0

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CAS Number	881835-86-5
Catalog Number	AG008BN0(AGN-PC-0VJMFL)
Chemical Name	4,6-Dioxoheptanoic acid-13C5
IUPAC Name	4,6-dioxo(3,4,5,6,7-13C5)heptanoic acid
InChI	InChI=1S/C7H10O4/c1-5(8)4-6(9)2-3-7(10)11/h2-4H2,1H3,(H,10,11)/i1+1,2+1,4+1,5+1,6+1
InChI Key	WYEPBHZLDUPIOD-JBSMRZEESA-N
MDL Number	MFCD00002797
Molecular Formula	C7H10O4
Molecular Weight	163.1152
SMILES	[13C](=O)([13CH2][13C](=O)[13CH3])[13CH2]CC(=O)O
Synonyms	Succinylacetone-13C5, 881835-86-5, 4,6-Dioxoheptanoic Acid-13C5, CTK8G3231, DTXSID60676144, NSC 174804-13C5, FT-0674728, 4,6-Dioxoheptanoic-3,4,5,6,7-13C5 Acid, 4,6-Dioxo(3,4,5,6,7-~13~C_5_)heptanoic acid, 4,6-Dioxoheptanoic acid-3,4,5,6,7-13C5, 99 atom % 13C, 97% (CP), Succinylacetone, 4,6-DIOXOHEPTANOIC ACID,

Complexity	183
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	163.075g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	5
Molecular Weight	163.115g/mol
Monoisotopic Mass	163.075g/mol
Rotatable Bond Count	5
Topological Polar Surface Area	71.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-0.8

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