3-chloro-4-(trifluoromethyl)benzamide

3-chloro-4-(trifluoromethyl)benzamide

CAS: 1092460-78-0

Formula: C8H5ClF3NO

SMILES: NC(=O)C1=CC(Cl)=C(C=C1)C(F)(F)F

IUPAC: 3-chloro-4-(trifluoromethyl)benzamide

InChI: InChI=1S/C8H5ClF3NO/c9-6-3-4(7(13)14)1-2-5(6)8(10,11)12/h1-3H,(H2,13,14)

Composition: C (42.98%), H (2.25%), Cl (15.86%), F (25.49%), N (6.26%), O (7.16%)

Molar Mass: 223.58

Atom Count: 19

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	223.001176
Formal Charge	0
FSP3	0.12
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
InChIKey	CESRVVBRBOSGJG-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	45.91
Topological Polar Surface Area	43.09
Polarizability	16.48
Ring Count	1
Rotatable Bond Count	2

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Purity	LeadTime	CAS	PacketSize	UnitPrice
97%	<2 Days	1092460-78-0		$51.35-$598.69$51.35$63.37$86.31$359.43$598.69