(2E)-3-(2,4-difluoro-3-methoxyphenyl)prop-2-enoic acid

(2E)-3-(2,4-difluoro-3-methoxyphenyl)prop-2-enoic acid

CAS: 886499-22-5

Formula: C10H8F2O3

SMILES: COC1=C(F)C=CC(C=CC(O)=O)=C1F

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

InChI: InChI=1S/C10H8F2O3/c1-15-10-7(11)4-2-6(9(10)12)3-5-8(13)14/h2-5H,1H3,(H,13,14)/b5-3+

Composition: C (56.08%), H (3.77%), F (17.74%), O (22.41%)

Molar Mass: 214.168

Atom Count: 23

Heavy Atom Count: 15

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	214.044150444
Formal Charge	0
FSP3	0.1
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	MVSJBWJGXKYERG-HWKANZROSA-N
Lipinski's Rule of Five	1
Molar Refractivity	49.96
Topological Polar Surface Area	46.53
Polarizability	18.19
Ring Count	1
Rotatable Bond Count	3

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Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<5 Days	886499-22-5		$2,060.00-$3,850.00$2,060.00$3,850.00