N-(cyclopropylmethyl)-2,6-dinitro-N-propyl-4-(trifluoromethyl)aniline

CAS: 26399-36-0

Molecular Formula	`C14H16F3N3O4`
Molecular Weight	347.29 g/mol
LogP	5.2
Topological Polar Surface Area	94.9 A2
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	8
Rotatable Bonds	5
Exact Mass	347.10928
Heavy Atoms	24
Complexity	449.0

Chemical Identifiers

CAS Number	26399-36-0
SMILES	`CCCN(CC1CC1)C2=C(C=C(C=C2[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]`
InChIKey	`ITVQAKZNYJEWKS-UHFFFAOYSA-N`

📖 Product Overview

N-(cyclopropylmethyl)-2,6-dinitro-N-propyl-4-(trifluoromethyl)aniline (CAS: 26399-36-0) is a chemical compound with molecular formula C14H16F3N3O4 and molecular weight 347.29 g/mol. Its IUPAC systematic name is N-(cyclopropylmethyl)-2,6-dinitro-N-propyl-4-(trifluoromethyl)aniline. LogP 5.2 Topological Polar Surface Area 94.9 A2 Hydrogen Bond Donors 0 Hydrogen Bond Acceptors 8 Rotatable Bonds 5 Exact Mass 347.10928 Heavy Atoms 24 Complexity 449.0 InChI Key: ITVQAKZNYJEWKS-UHFFFAOYSA-N. SMILES: CCCN(CC1CC1)C2=C(C=C(C=C2[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-].

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.

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📚 Academic Support

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