Name: Name:3-Furancarboxylic acid, 2-methyl-4-(trifluoromethyl)-, ethyl ester
Brand: Angene
SKU: AG002T7L
Rating: 90 (10 reviews)

3-Furancarboxylic acid, 2-methyl-4-(trifluoromethyl)-, ethyl ester

CAS No.:

26431-52-7

Catalog Number:

AG002T7L

Molecular Formula:

C9H9F3O3

Molecular Weight:

222.1612

Catalog Number:

AG002T7L

Chemical Name:

3-Furancarboxylic acid, 2-methyl-4-(trifluoromethyl)-, ethyl ester

CAS Number:

26431-52-7

Molecular Formula:

C9H9F3O3

Molecular Weight:

222.1612

MDL Number:

MFCD18633627

IUPAC Name:

ethyl 2-methyl-4-(trifluoromethyl)furan-3-carboxylate

InChI:

InChI=1S/C9H9F3O3/c1-3-14-8(13)7-5(2)15-4-6(7)9(10,11)12/h4H,3H2,1-2H3

InChI Key:

RQRLSFQHDQTZEF-UHFFFAOYSA-N

SMILES:

CCOC(=O)c1c(C)occ1C(F)(F)F

Complexity:

239

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

222.05g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

222.163g/mol

Monoisotopic Mass:

222.05g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

39.4A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.5