methyl (2E)-3-[3-(trifluoromethyl)phenyl]prop-2-enoate

methyl (2E)-3-[3-(trifluoromethyl)phenyl]prop-2-enoate

CAS: 104201-66-3

Formula: C11H9F3O2

SMILES: COC(=O)C=CC1=CC(=CC=C1)C(F)(F)F

IUPAC: methyl (2E)-3-[3-(trifluoromethyl)phenyl]prop-2-enoate

InChI: InChI=1S/C11H9F3O2/c1-16-10(15)6-5-8-3-2-4-9(7-8)11(12,13)14/h2-7H,1H3/b6-5+

Composition: C (57.40%), H (3.94%), F (24.76%), O (13.90%)

Molar Mass: 230.186

Atom Count: 25

Heavy Atom Count: 16

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	230.055464019
Formal Charge	0
FSP3	0.18
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
InChIKey	ZQAIZQSBGPNEEN-AATRIKPKSA-N
Lipinski's Rule of Five	1
Molar Refractivity	53.8
Topological Polar Surface Area	26.3
Polarizability	19.38
Ring Count	1
Rotatable Bond Count	4

Suppliers

Molecule Market Select

Purity	LeadTime	CAS		UnitPrice
98%	<10 Days	104201-66-3		Quote Only

LabNetwork INC

Supplier Profile

Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	1 Day	104201-66-3		$88.45-$1,939.14$88.45$170.10$340.20$1,020.60$1,939.14