1,3-diethyl 2-acetamido-2-{[4-(trifluoromethyl)phenyl]methyl}propanedioate

1,3-diethyl 2-acetamido-2-{[4-(trifluoromethyl)phenyl]methyl}propanedioate

Formula: C17H20F3NO5

SMILES: CCOC(=O)C(CC1=CC=C(C=C1)C(F)(F)F)(NC(C)=O)C(=O)OCC

IUPAC: 1,3-diethyl 2-acetamido-2-{[4-(trifluoromethyl)phenyl]methyl}propanedioate

InChI: InChI=1S/C17H20F3NO5/c1-4-25-14(23)16(21-11(3)22,15(24)26-5-2)10-12-6-8-13(9-7-12)17(18,19)20/h6-9H,4-5,10H2,1-3H3,(H,21,22)

Composition: C (54.40%), H (5.37%), F (15.18%), N (3.73%), O (21.31%)

Molar Mass: 375.344

Atom Count: 46

Heavy Atom Count: 26

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	375.129357237
Formal Charge	0
FSP3	0.47
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	LXAJIJSLEAJJLQ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	85.77
Topological Polar Surface Area	81.7
Polarizability	32.77
Ring Count	1
Rotatable Bond Count	10

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C17H20F3NO5		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00