Name: Name:Methyl 3-([3-(trifluoromethyl)benzyl]oxy)-2-thiophenecarboxylate
Brand: Angene
SKU: AG00DDNH
Rating: 90 (10 reviews)

Methyl 3-([3-(trifluoromethyl)benzyl]oxy)-2-thiophenecarboxylate

CAS No.:

343375-98-4

Catalog Number:

AG00DDNH

Molecular Formula:

C14H11F3O3S

Molecular Weight:

316.2955

Catalog Number:

AG00DDNH

Chemical Name:

Methyl 3-([3-(trifluoromethyl)benzyl]oxy)-2-thiophenecarboxylate

CAS Number:

343375-98-4

Molecular Formula:

C14H11F3O3S

Molecular Weight:

316.2955

MDL Number:

MFCD00202083

IUPAC Name:

methyl 3-[[3-(trifluoromethyl)phenyl]methoxy]thiophene-2-carboxylate

InChI:

InChI=1S/C14H11F3O3S/c1-19-13(18)12-11(5-6-21-12)20-8-9-3-2-4-10(7-9)14(15,16)17/h2-7H,8H2,1H3

InChI Key:

AWWGGWWMTZUJDX-UHFFFAOYSA-N

SMILES:

COC(=O)c1sccc1OCc1cccc(c1)C(F)(F)F

Complexity:

362

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

316.038g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

316.294g/mol

Monoisotopic Mass:

316.038g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

63.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

4.1