1-[2-nitro-4-(trifluoromethyl)phenyl]-1,4-diazepane

Modify Date: 2025-09-10 18:22:42

1-[2-nitro-4-(trifluoromethyl)phenyl]-1,4-diazepane Structure
1-[2-nitro-4-(trifluoromethyl)phenyl]-1,4-diazepane structure
Common Name 1-[2-nitro-4-(trifluoromethyl)phenyl]-1,4-diazepane
CAS Number 646455-48-3 Molecular Weight 289.25400
Density 1.309g/cm3 Boiling Point 380.3ºC at 760 mmHg
Molecular Formula C12H14F3N3O2 Melting Point N/A
MSDS N/A Flash Point 183.8ºC

 Names

Name 1-[2-nitro-4-(trifluoromethyl)phenyl]-1,4-diazepane
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.309g/cm3
Boiling Point 380.3ºC at 760 mmHg
Molecular Formula C12H14F3N3O2
Molecular Weight 289.25400
Flash Point 183.8ºC
Exact Mass 289.10400
PSA 61.09000
LogP 3.33030
Index of Refraction 1.509
InChIKey NPWQDZRJYNUBQA-UHFFFAOYSA-N
SMILES O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1CCCNCC1

 Safety Information

Hazard Codes Xi
HS Code 2933990090

 Customs

HS Code 2933990090
Summary 2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

 Synonyms

HMS2737N21
1-[2-nitro-4-(trifluoromethyl)phenyl]homopiperazine
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