(2E)-3-(4-fluoro-3-methoxyphenyl)prop-2-enoic acid

(2E)-3-(4-fluoro-3-methoxyphenyl)prop-2-enoic acid

CAS: 630424-79-2

Formula: C10H9FO3

SMILES: COC1=C(F)C=CC(C=CC(O)=O)=C1

IUPAC: (2E)-3-(4-fluoro-3-methoxyphenyl)prop-2-enoic acid

InChI: InChI=1S/C10H9FO3/c1-14-9-6-7(2-4-8(9)11)3-5-10(12)13/h2-6H,1H3,(H,12,13)/b5-3+

Composition: C (61.23%), H (4.62%), F (9.68%), O (24.47%)

Molar Mass: 196.177

Atom Count: 23

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	196.053572313
Formal Charge	0
FSP3	0.1
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	NVEDFCULNXTLOA-HWKANZROSA-N
Lipinski's Rule of Five	1
Molar Refractivity	49.74
Topological Polar Surface Area	46.53
Polarizability	18.37
Ring Count	1
Rotatable Bond Count	3

Suppliers

Struchem co.,ltd

Supplier Profile

Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<5 Days	630424-79-2		$1,474.00-$3,894.00$1,474.00$2,596.00$3,894.00