2,3-difluoro-4-(trifluoromethyl)aniline

2,3-difluoro-4-(trifluoromethyl)aniline

CAS: 123950-46-9

Formula: C7H4F5N

SMILES: NC1=CC=C(C(F)=C1F)C(F)(F)F

IUPAC: 2,3-difluoro-4-(trifluoromethyl)aniline

InChI: InChI=1S/C7H4F5N/c8-5-3(7(10,11)12)1-2-4(13)6(5)9/h1-2H,13H2

Composition: C (42.66%), H (2.05%), F (48.19%), N (7.11%)

Molar Mass: 197.108

Atom Count: 17

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	197.026389948
Formal Charge	0
FSP3	0.14
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
InChIKey	RRTVKWPCWJVMGM-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	37.16
Topological Polar Surface Area	26.02
Polarizability	12.56
Ring Count	1
Rotatable Bond Count	1

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