AG008WFO

Name: Caffeic acid-13C3
Brand: Angene Chemical
SKU: AG008WFO

1185245-82-2 | Caffeic acid-13C3

AG008WFO

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CAS Number	1185245-82-2
Catalog Number	AG008WFO(AGN-PC-0WAGO6)
Chemical Name	Caffeic acid-13C3
IUPAC Name	3-(3,4-dihydroxyphenyl)(1,2,3-13C3)prop-2-enoic acid
InChI	InChI=1S/C9H8O4/c10-7-3-1-6(5-8(7)11)2-4-9(12)13/h1-5,10-11H,(H,12,13)/i2+1,4+1,9+1
InChI Key	QAIPRVGONGVQAS-CTEGUFHBSA-N
Molecular Formula	C9H8O4
Molecular Weight	183.1354
SMILES	OC1=C(O)C=C(/[13CH]=[13CH]/[13C](O)=O)C=C1
Synonyms	1185245-82-2, CTK8F8412, AKOS030243117, FT-0664186, Caffeic Acid-13C3, Caffeic Acid 13C3,

Complexity	212
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	183.052g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	3
Isotope Atom Count	3
Molecular Weight	183.136g/mol
Monoisotopic Mass	183.052g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	77.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	1
XLogP3	1.2

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