AG01C83C

Name: Isochroman-7-carboxylic acid
Brand: Angene Chemical
SKU: AG01C83C

157122-41-3 | Isochroman-7-carboxylic acid

AG01C83C

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CAS Number	157122-41-3
Catalog Number	AG01C83C(AGN-PC-0234CK)
Chemical Name	Isochroman-7-carboxylic acid
IUPAC Name	3,4-dihydro-1H-isochromene-7-carboxylic acid
InChI	InChI=1S/C10H10O3/c11-10(12)8-2-1-7-3-4-13-6-9(7)5-8/h1-2,5H,3-4,6H2,(H,11,12)
InChI Key	PQXSBRDZOFRXPO-UHFFFAOYSA-N
MDL Number	MFCD22536225
Molecular Formula	C10H10O3
Molecular Weight	178.1846
SMILES	C1OCCC2=CC=C(C=C12)C(=O)O
Synonyms	Isochroman-7-carboxylic acid, 157122-41-3, 7-Carboxyisochroman, SCHEMBL5286604, PQXSBRDZOFRXPO-UHFFFAOYSA-N, AKOS022910335, 3,4-dihydro-1H-2-benzopyran-7-carboxylic acid,

Complexity	202
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	178.063g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	178.187g/mol
Monoisotopic Mass	178.063g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	46.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.1

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