2-amino-6-(trifluoromethyl)phenol

2-amino-6-(trifluoromethyl)phenol

CAS: 72534-45-3

Formula: C7H6F3NO

SMILES: NC1=CC=CC(=C1O)C(F)(F)F

IUPAC: 2-amino-6-(trifluoromethyl)phenol

InChI: InChI=1S/C7H6F3NO/c8-7(9,10)4-2-1-3-5(11)6(4)12/h1-3,12H,11H2

Composition: C (47.47%), H (3.41%), F (32.18%), N (7.91%), O (9.03%)

Molar Mass: 177.126

Atom Count: 18

Heavy Atom Count: 12

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	177.040148306
Formal Charge	0
FSP3	0.14
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
InChIKey	XOXAZFFGKMIJKE-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	38.71
Topological Polar Surface Area	46.25
Polarizability	13.38
Ring Count	1
Rotatable Bond Count	1

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Purity	LeadTime	CAS	PacketSize	UnitPrice
96%	<7 Days	72534-45-3		$52.79-$775.22$52.79$75.56$224.60$775.22