AG005IWD

Name: 2,3-DIHYDROBENZO[B][1,4]OXAZEPIN-4(5H)-ONE
Brand: Angene Chemical
SKU: AG005IWD

704-48-3 | 2,3-DIHYDROBENZO[B][1,4]OXAZEPIN-4(5H)-ONE

AG005IWD

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CAS Number	704-48-3
Catalog Number	AG005IWD(AGN-PC-00KE42)
Chemical Name	2,3-DIHYDROBENZO[B][1,4]OXAZEPIN-4(5H)-ONE
IUPAC Name	3,5-dihydro-2H-1,5-benzoxazepin-4-one
InChI	InChI=1S/C9H9NO2/c11-9-5-6-12-8-4-2-1-3-7(8)10-9/h1-4H,5-6H2,(H,10,11)
InChI Key	VQUQMVAKPPWYNT-UHFFFAOYSA-N
MDL Number	MFCD09832136
Molecular Formula	C9H9NO2
Molecular Weight	163.1733
SMILES	O=C1NC2=C(C=CC=C2)OCC1
Synonyms	704-48-3, 2,3,4,5-tetrahydro-1,5-benzoxazepin-4-one, 2,3-Dihydrobenzo[b][1,4]oxazepin-4(5H)-one, 2,3-dihydro-1,5-benzoxazepin-4(5h)-one, 1,5-Benzoxazepin-4(5H)-one, 2,3-dihydro-, AC1Q6ESL, 1,3,4,5-Tetrahydro-5-oxa-benzo[b]azepin-2-one, SCHEMBL1756086, CTK2G2989, DTXSID30514620, VQUQMVAKPPWYNT-UHFFFAOYSA-N, MFCD09832136, ZINC36378444, AKOS022468273, MCULE-8447556892, EN300-41608, 04T483, AB01002664-01, 6,7-Dihydro-9H-5-oxa-9-aza-benzocyclohepten-8-one,

Complexity	181
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	163.063g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	163.176g/mol
Monoisotopic Mass	163.063g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	38.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.8

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