2,2,2-trifluoro-N-{[4-(hydroxymethyl)phenyl]methyl}acetamide

2,2,2-trifluoro-N-{[4-(hydroxymethyl)phenyl]methyl}acetamide

CAS: 171723-95-8

Formula: C10H10F3NO2

SMILES: OCC1=CC=C(CNC(=O)C(F)(F)F)C=C1

IUPAC: 2,2,2-trifluoro-N-{[4-(hydroxymethyl)phenyl]methyl}acetamide

InChI: InChI=1S/C10H10F3NO2/c11-10(12,13)9(16)14-5-7-1-3-8(6-15)4-2-7/h1-4,15H,5-6H2,(H,14,16)

Composition: C (51.51%), H (4.32%), F (24.44%), N (6.01%), O (13.72%)

Molar Mass: 233.19

Atom Count: 26

Heavy Atom Count: 16

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	233.066363055
Formal Charge	0
FSP3	0.3
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
InChIKey	BRPKWGMIAIWOJL-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	51.8
Topological Polar Surface Area	49.33
Polarizability	18.96
Ring Count	1
Rotatable Bond Count	4

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Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<5 Days	171723-95-8		$56.75-$1,619.12$56.75$75.66$107.19$239.59$1,017.63$1,619.12