AG00FEK1

Name: Heptelidic acid
Brand: Angene Chemical
SKU: AG00FEK1

74310-84-2 | Heptelidic acid

AG00FEK1

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COA

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WARNING This product is not for human or veterinary use.

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CAS Number	74310-84-2
Catalog Number	AG00FEK1(AGN-PC-0WAISX)
Chemical Name	Heptelidic acid
IUPAC Name	1-oxo-6-propan-2-ylspiro[3,5a,6,7,8,9a-hexahydro-2-benzoxepine-9,2'-oxirane]-4-carboxylic acid
InChI	InChI=1S/C15H20O5/c1-8(2)10-3-4-15(7-20-15)12-11(10)5-9(13(16)17)6-19-14(12)18/h5,8,10-12H,3-4,6-7H2,1-2H3,(H,16,17)
InChI Key	JESMSCGUTIEROV-UHFFFAOYSA-N
MDL Number	MFCD01684016
Molecular Formula	C15H20O5
Molecular Weight	280.3163
SMILES	O=C(O)C1=CC2C(C(=O)OC1)C3(OC3)CCC2C(C)C
Synonyms	heptelidic acid, koningic acid, Heptelidic acid, 74310-84-2, Avocettin, Koningic acid, C15-H20-O5, BRN 5091359, CID10016502, 57710-57-3,

Complexity	481
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	280.131g/mol
Formal Charge	0
Heavy Atom Count	20
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	280.32g/mol
Monoisotopic Mass	280.131g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	76.1A^2
Undefined Atom Stereocenter Count	4
Undefined Bond Stereocenter Count	0
XLogP3	1.4

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