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Home >> Chemical Listing >> Page 2119 >> 1-[2-Nitro-4-(trifluoromethyl)phenyl]-1,4-diazepane

1-[2-Nitro-4-(trifluoromethyl)phenyl]-1,4-diazepane
[CAS# 646455-48-3]

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Identification
Name 1-[2-Nitro-4-(trifluoromethyl)phenyl]-1,4-diazepane
Synonyms 1-[2-Nitro-4-(trifluoromethyl)-phenyl]-1,4-diazepane; 1-[2-Nitro-4-(trifluoromethyl)phenyl]homopiperazine; 1-[2-Nitro-4-(trifluoromethyl)phenyl]homopiperazine hydrochloride
Molecular Structure CAS#: 646455-48-3, 1-[2-Nitro-4-(trifluoromethyl)phenyl]-1,4-diazepane
Molecular Formula C12H14F3N3O2
Molecular Weight 289.25
CAS Registry Number 646455-48-3
SMILES C1CNCCN(C1)C2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-]
InChI 1S/C12H14F3N3O2/c13-12(14,15)9-2-3-10(11(8-9)18(19)20)17-6-1-4-16-5-7-17/h2-3,8,16H,1,4-7H2
InChIKey NPWQDZRJYNUBQA-UHFFFAOYSA-N
Properties
Density 1.3±0.1g/cm3 (Cal.)
Boiling point 380.3±42.0°C at 760 mmHg (Cal.)
Flash point 183.8±27.9°C (Cal.)
Refractive index 1.509 (Cal.)
Safety Data
Safety Description R36/37/38
IRRITANT
Irritant
S24/25,S36/37/39,S45
SDS Available
Market Analysis Reports
List of Reports Available for 1-[2-Nitro-4-(trifluoromethyl)phenyl]-1,4-diazepane
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