4-bromo-2-(trifluoromethyl)aniline

4-bromo-2-(trifluoromethyl)aniline

CAS: 445-02-3

Formula: C7H5BrF3N

SMILES: NC1=CC=C(Br)C=C1C(F)(F)F

IUPAC: 4-bromo-2-(trifluoromethyl)aniline

InChI: InChI=1S/C7H5BrF3N/c8-4-1-2-6(12)5(3-4)7(9,10)11/h1-3H,12H2

Composition: C (35.03%), H (2.10%), Br (33.29%), F (23.75%), N (5.84%)

Molar Mass: 240.023

Atom Count: 17

Heavy Atom Count: 12

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	238.955747
Formal Charge	0
FSP3	0.14
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
InChIKey	PHXGKHTWEOPCEW-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	44.35
Topological Polar Surface Area	26.02
Polarizability	15.84
Ring Count	1
Rotatable Bond Count	1

Suppliers

Molecule Market Select

Purity	LeadTime	CAS	PacketSize	UnitPrice
99.65%	<7 Days	445-02-3		$161.76$161.76

AA BLOCKS INC

Supplier Profile

Purity	LeadTime	CAS	PacketSize	UnitPrice
98%	<6 Days	445-02-3		$18.40-$235.75$18.40$27.60$62.10$235.75

Molecule Market Select

Purity	LeadTime	CAS	PacketSize	UnitPrice
98%	<7 Days	445-02-3		$6.21-$170.78$6.21$9.32$11.39$37.26$170.78

Struchem co.,ltd

Supplier Profile

Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<5 Days	445-02-3		$702.00$702.00

Kinentia Biosciences LLC

Supplier Profile

Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<14 Days	445-02-3		$94.50$94.50

Molecule Market Select

Purity	LeadTime	CAS	PacketSize	UnitPrice
98%	<5 Days	445-02-3		$39.09-$409.83$39.09$49.18$103.40$409.83