1,2,3,4-tetrahydro-2-benzazepin-5-one hydrochloride

1,2,3,4-tetrahydro-2-benzazepin-5-one hydrochloride

CAS: 1215074-38-6

Formula: C10H12ClNO

SMILES: Cl[H].O=C1CCNCC2=CC=CC=C12

IUPAC: 2,3,4,5-tetrahydro-1H-2-benzazepin-5-one hydrochloride

InChI: InChI=1S/C10H11NO.ClH/c12-10-5-6-11-7-8-3-1-2-4-9(8)10;/h1-4,11H,5-7H2;1H

Composition: C (60.77%), H (6.12%), Cl (17.93%), N (7.09%), O (8.09%)

Molar Mass: 197.66

Atom Count: 25

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	197.0607417
Formal Charge	0
FSP3	0.3
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	XMJOGYVBAYXIPS-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	47.85
Topological Polar Surface Area	29.1
Polarizability	18.55
Ring Count	2
Rotatable Bond Count	0

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Purity	LeadTime	CAS	PacketSize	UnitPrice
99.5%	<7 Days	1215074-38-6		$57.97-$320.71$57.97$100.98$320.71