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

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

CAS: 107570-54-7

Formula: C7H4F5NO

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

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

InChI: InChI=1S/C7H4F5NO/c8-5-3(13)1-2-4(6(5)9)14-7(10,11)12/h1-2H,13H2

Composition: C (39.45%), H (1.89%), F (44.57%), N (6.57%), O (7.51%)

Molar Mass: 213.107

Atom Count: 18

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	213.021304568
Formal Charge	0
FSP3	0.14
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	SLBZPAVVVANJBN-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	34.26
Topological Polar Surface Area	35.25
Polarizability	13.38
Ring Count	1
Rotatable Bond Count	2

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