AG007QW6

Name: diendo-3-Benzoyl-bicyclo[2.2.1]heptane-2-carboxylic acid
Brand: Angene Chemical
SKU: AG007QW6

212757-12-5 | diendo-3-Benzoyl-bicyclo[2.2.1]heptane-2-carboxylic acid

AG007QW6

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CAS Number	212757-12-5
Catalog Number	AG007QW6(AGN-PC-0QXTN9)
Chemical Name	diendo-3-Benzoyl-bicyclo[2.2.1]heptane-2-carboxylic acid
IUPAC Name	(1S,2S,3R,4R)-3-benzoylbicyclo[2.2.1]heptane-2-carboxylic acid
InChI	InChI=1S/C15H16O3/c16-14(9-4-2-1-3-5-9)12-10-6-7-11(8-10)13(12)15(17)18/h1-5,10-13H,6-8H2,(H,17,18)/t10-,11+,12-,13+/m1/s1
InChI Key	GGRGOXDLLVXREZ-XQHKEYJVSA-N
MDL Number	MFCD09260353
Molecular Formula	C15H16O3
Molecular Weight	244.2857
SMILES	OC(=O)[C@@H]1[C@@H]2CC[C@H]([C@@H]1C(=O)c1ccccc1)C2
Synonyms	diendo-3-Benzoyl-bicyclo[2.2.1]heptane-2-carboxylic acid, 212757-12-5, ZINC4262301, MFCD09260353, AB49807, RT-012320, T6449, (1beta,4beta)-3alpha-Benzoylbicyclo[2.2.1]heptane-2alpha-carboxylic acid, TimTec1_000799, CID11886838,

Complexity	357
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	4
Defined Bond Stereocenter Count	0
Exact Mass	244.11g/mol
Formal Charge	0
Heavy Atom Count	18
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	244.29g/mol
Monoisotopic Mass	244.11g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	54.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.8

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