AG01E2SB

Name: 3-Methoxy-6,7,8,9-tetrahydro-5H-benzo[7]annulen-6-one
Brand: Angene Chemical
SKU: AG01E2SB

91495-63-5 | 3-Methoxy-6,7,8,9-tetrahydro-5H-benzo[7]annulen-6-one

AG01E2SB

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CAS Number	91495-63-5
Catalog Number	AG01E2SB(AGN-PC-0N6KSN)
Chemical Name	3-Methoxy-6,7,8,9-tetrahydro-5H-benzo[7]annulen-6-one
IUPAC Name	3-methoxy-5,7,8,9-tetrahydrobenzo[7]annulen-6-one
InChI	InChI=1S/C12H14O2/c1-14-12-6-5-9-3-2-4-11(13)7-10(9)8-12/h5-6,8H,2-4,7H2,1H3
InChI Key	ZWBQKDCWKNWSRU-UHFFFAOYSA-N
MDL Number	MFCD15527451
Molecular Formula	C12H14O2
Molecular Weight	190.2384
SMILES	COC1=CC2=C(CCCC(C2)=O)C=C1
Synonyms	91495-63-5, 3-METHOXY-6,7,8,9-TETRAHYDRO-5H-BENZO[7]ANNULEN-6-ONE, SCHEMBL3813236, ZWBQKDCWKNWSRU-UHFFFAOYSA-N, 3-methoxy-5,7,8,9-tetrahydro-6h-benzocyclohepten-6-one, 3-Methoxy-5,7,8,9-tetrahydro-6H-benzocycloheptene-6-one, 3-methoxy-6,7,8,9-tetrahydro-5H-benzocyclohepten-6-one, CID10559574, 9-methoxybicyclo[5.4.0]undeca-8,10,12-trien-5-one, 6H-Benzocyclohepten-6-one, 5,7,8,9-tetrahydro-3-methoxy,

Complexity	212
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	190.099g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	190.242g/mol
Monoisotopic Mass	190.099g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	26.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.9

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