6-bromo-2-methyl-3-(trifluoromethyl)aniline

6-bromo-2-methyl-3-(trifluoromethyl)aniline

Formula: C8H7BrF3N

SMILES: CC1=C(C=CC(Br)=C1N)C(F)(F)F

IUPAC: 6-bromo-2-methyl-3-(trifluoromethyl)aniline

InChI: InChI=1S/C8H7BrF3N/c1-4-5(8(10,11)12)2-3-6(9)7(4)13/h2-3H,13H2,1H3

Composition: C (37.82%), H (2.78%), Br (31.45%), F (22.43%), N (5.51%)

Molar Mass: 254.05

Atom Count: 20

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	252.971397
Formal Charge	0
FSP3	0.25
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
InChIKey	VRHLXCVLUDMNEM-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	49.4
Topological Polar Surface Area	26.02
Polarizability	17.53
Ring Count	1
Rotatable Bond Count	1

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Purity	LeadTime	Formula		UnitPrice
98%	<10 Days	C8H7BrF3N		Quote Only