AG002JLL

208245-76-5 | 1,4-Diazepan-5-one, HCl

AG002JLL

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CAS Number	208245-76-5
Catalog Number	AG002JLL(AGN-PC-03YNZS)
Chemical Name	1,4-Diazepan-5-one, HCl
IUPAC Name	1,4-diazepan-5-one;hydrochloride
InChI	InChI=1S/C5H10N2O.ClH/c8-5-1-2-6-3-4-7-5;/h6H,1-4H2,(H,7,8);1H
InChI Key	WOSZTROLFNNEIW-UHFFFAOYSA-N
MDL Number	MFCD09864983
Molecular Formula	C5H11ClN2O
Molecular Weight	150.6066
SMILES	O=C1NCCNCC1.[H]Cl
Synonyms	1,4-diazepan-5-one hydrochloride, 208245-76-5, 1,4-DIAZEPAN-5-ONE HCL, 1,4-diazaperhydroepin-5-one, chloride, ACMC-20a2h7, AC1Q3EL0, 1,4-Diazepan-5-one, HCl, SCHEMBL2917967, CTK7H6574, DTXSID10630498, Homopiperazin-5-one hydrochloride, WOSZTROLFNNEIW-UHFFFAOYSA-N, 1,4-diazepan-5-one,hydrochloride, ANW-54137, MFCD09864983, SBB056241, AKOS015847968, CD-1035, CS-W003673, MCULE-1867860146, PS-8924, RP21422, RP21423, RTR-009794, VZ20687, KS-0000052I, AC-26733, AK-25582, BC270533, BR-25582, SY019808, AB0023337, ST2414847, TR-009794, 4CH-000664, AM20090172, FT-0648954, ST50950102, W4371, EN300-69107, MFCD09864983 (95%), Hexahydro-1H-1,4-diazepin-5-one hydrochloride, S-3115, 1,4-Diazepan-5-one--hydrogen chloride (1/1), 5H-1,4-Diazepin-5-one, hexahydro-, hydrochloride, A1-00410, J-503979, F8880-3444, 5H-1,4-Diazepin-5-one, hexahydro-, hydrochloride (1:1), Homopiperazin-5-one hydrochloride;1,4-diazepan-5-one(HCl), C5H11ClN2O, 1,4-Diazepan-5-onehydrochloride, 34376-54-0,

Complexity	92.4
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	150.056g/mol
Formal Charge	0
Heavy Atom Count	9
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	3
Isotope Atom Count	0
Molecular Weight	150.606g/mol
Monoisotopic Mass	150.056g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	41.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number