3-(Hexahydro-1H-azepin-1-yl)-3'-nitropropiophenone hydrochloride

CAS

13492-21-2

Catalog Number

ACM13492212

Category

Other Products

Molecular Weight

312.791840 [g/mol]

Molecular Formula

C₁₅H₂₀N₂O₃.HCl

MSDS COA Spec Sheet

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Specification

Synonyms

Phenitrone, Phenitron, Phenytron, TG-6, EINECS 236-808-7, 3670-65-3 (Parent), NSC 150074, CID197917, LS-125312, 3-(Hexahydro-1H-azepin-1-yl)-3-nitropropiophenone hydrochloride, Propiophenone, 3-(hexahydro-1H-azepin-1-yl)-3-nitro-, monohydrochloride, 1-Propanone, 3-(hexahydro-1H-azepin-1-yl)-1-(3-nitrophenyl)-, monohydrochloride, 1-Propanone, 3-(hexahydro-1H-azepin-1-yl)-1-(3-nitrophenyl)-, monohydrochloride (9CI), 13492-21-2

IUPAC Name

3-(azepan-1-yl)-1-(3-nitrophenyl)propan-1-one hydrochloride

Canonical SMILES

C1CCCN(CC1)CCC(=O)C2=CC(=CC=C2)[N+](=O)[O-].Cl

InChI Key

GZSMZOZGZVJTLF-UHFFFAOYSA-N

Boiling Point

401.8ºC at 760mmHg

Flash Point

196.8ºC

EC Number

236-808-7