AG006Z65

22245-92-7 | 7-amino-1,3,4,5-tetrahydro-2H-1-benzazepin-2-one

AG006Z65

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CAS Number	22245-92-7
Catalog Number	AG006Z65(AGN-PC-0M911S)
Chemical Name	7-amino-1,3,4,5-tetrahydro-2H-1-benzazepin-2-one
IUPAC Name	7-amino-1,3,4,5-tetrahydro-1-benzazepin-2-one
InChI	InChI=1S/C10H12N2O/c11-8-4-5-9-7(6-8)2-1-3-10(13)12-9/h4-6H,1-3,11H2,(H,12,13)
InChI Key	QEZZUFANNFFZIH-UHFFFAOYSA-N
MDL Number	MFCD09260841
Molecular Formula	C10H12N2O
Molecular Weight	176.2151
SMILES	O=C1CCCC2=CC(N)=CC=C2N1
Synonyms	22245-92-7, 7-AMINO-4,5-DIHYDRO-1H-BENZO[B]AZEPIN-2(3H)-ONE, 7-amino-2,3,4,5-tetrahydro-1H-1-benzazepin-2-one, 7-AMINO-1,3,4,5-TETRAHYDRO-BENZO[B]AZEPIN-2-ONE, 2H-1-BENZAZEPIN-2-ONE, 7-AMINO-1,3,4,5-TETRAHYDRO-, AC1P1Y0A, AC1Q52EU, SCHEMBL519951, CTK4E8981, DTXSID40429110, QEZZUFANNFFZIH-UHFFFAOYSA-N, ZINC7023364, MFCD09260841, SBB089176, AKOS009165943, ACN-034833, MCULE-7039817017, PB29619, AJ-57082, AS-42137, AB0081816, CS-0004303, EN300-69099, 45A927, 7-amino-1H,3H,4H,5H-benzo[f]azepin-2-one, Q-1805, 7-amino-1,3,4,5-tetrahydro-1-benzazepin-2-one, 7-amino-1,3,4,5-tetrahydro-2H-1-benzazepin-2-one, 7-amino-1,3,4,5-tetrahydro-2H-benzo[b]azepin-2-one, Z291280252, ZINC07023364, CID8167210,

Complexity	205
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	176.095g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	176.219g/mol
Monoisotopic Mass	176.095g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	55.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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