2-methyl-4-(trifluoromethoxy)benzamide

2-methyl-4-(trifluoromethoxy)benzamide

CAS: 261951-90-0

Formula: C9H8F3NO2

SMILES: CC1=CC(OC(F)(F)F)=CC=C1C(N)=O

IUPAC: 2-methyl-4-(trifluoromethoxy)benzamide

InChI: InChI=1S/C9H8F3NO2/c1-5-4-6(15-9(10,11)12)2-3-7(5)8(13)14/h2-4H,1H3,(H2,13,14)

Composition: C (49.32%), H (3.68%), F (26.01%), N (6.39%), O (14.60%)

Molar Mass: 219.163

Atom Count: 23

Heavy Atom Count: 15

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	219.050712991
Formal Charge	0
FSP3	0.22
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	QEKHHJYCFMGGDB-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	43.25
Topological Polar Surface Area	52.32
Polarizability	16.97
Ring Count	1
Rotatable Bond Count	3

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