2,6-dichloro-4-(trifluoromethoxy)aniline

2,6-dichloro-4-(trifluoromethoxy)aniline

CAS: 99479-66-0

Formula: C7H4Cl2F3NO

SMILES: NC1=C(Cl)C=C(OC(F)(F)F)C=C1Cl

IUPAC: 2,6-dichloro-4-(trifluoromethoxy)aniline

InChI: InChI=1S/C7H4Cl2F3NO/c8-4-1-3(14-7(10,11)12)2-5(9)6(4)13/h1-2H,13H2

Composition: C (34.18%), H (1.64%), Cl (28.82%), F (23.17%), N (5.69%), O (6.50%)

Molar Mass: 246.01

Atom Count: 18

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	244.9622036
Formal Charge	0
FSP3	0.14
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	FKISQWQHZULEEG-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	43.44
Topological Polar Surface Area	35.25
Polarizability	17.49
Ring Count	1
Rotatable Bond Count	2

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