AG00DLJ6

Name: 7-METHOXY-2,3,4,5-TETRAHYDRO-1-BENZOXEPIN-5-ONE
Brand: Angene Chemical
SKU: AG00DLJ6

55580-00-2 | 7-METHOXY-2,3,4,5-TETRAHYDRO-1-BENZOXEPIN-5-ONE

AG00DLJ6

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CAS Number	55580-00-2
Catalog Number	AG00DLJ6(AGN-PC-00MWRQ)
Chemical Name	7-METHOXY-2,3,4,5-TETRAHYDRO-1-BENZOXEPIN-5-ONE
IUPAC Name	7-methoxy-3,4-dihydro-2H-1-benzoxepin-5-one
InChI	InChI=1S/C11H12O3/c1-13-8-4-5-11-9(7-8)10(12)3-2-6-14-11/h4-5,7H,2-3,6H2,1H3
InChI Key	CZDQPKDUJDKJRF-UHFFFAOYSA-N
MDL Number	MFCD11206488
Molecular Formula	C11H12O3
Molecular Weight	192.2112
SMILES	COC1=CC2=C(OCCCC2=O)C=C1
Synonyms	55580-00-2, 7-methoxy-2,3,4,5-tetrahydro-1-benzoxepin-5-one, 7-methoxy-3,4-dihydro-1-benzoxepin-5(2H)-one, SCHEMBL8029261, CZDQPKDUJDKJRF-UHFFFAOYSA-N, ZINC34079475, AKOS005363335, MCULE-5932994358, NE22726, 7-methoxy-3,4-dihydro-1-benzoxepin-5-one, 7-Methoxy-2,3-dihydro-1-benzoxepin-5(4H)-one, 7-methoxy-3,4-dihydrobenzo[b]oxepin-5(2H)-one, 1-Benzoxepin-5(2H)-one, 3,4-dihydro-7-methoxy-,

Complexity	215
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	192.079g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	192.214g/mol
Monoisotopic Mass	192.079g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	35.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.7

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