Name: Name:2-(2,2,2-TRIFLUOROETHYL)-1,3-BENZOXAZOLE-5-CARBOXYLIC ACID
Brand: Angene
SKU: AG01EKHB
Rating: 90 (10 reviews)

2-(2,2,2-TRIFLUOROETHYL)-1,3-BENZOXAZOLE-5-CARBOXYLIC ACID

CAS No.:

1500287-53-5

Catalog Number:

AG01EKHB

Molecular Formula:

C10H6F3NO3

Molecular Weight:

245.1547

Catalog Number:

AG01EKHB

Chemical Name:

2-(2,2,2-TRIFLUOROETHYL)-1,3-BENZOXAZOLE-5-CARBOXYLIC ACID

CAS Number:

1500287-53-5

Molecular Formula:

C10H6F3NO3

Molecular Weight:

245.1547

MDL Number:

MFCD23556505

IUPAC Name:

2-(2,2,2-trifluoroethyl)-1,3-benzoxazole-5-carboxylic acid

InChI:

InChI=1S/C10H6F3NO3/c11-10(12,13)4-8-14-6-3-5(9(15)16)1-2-7(6)17-8/h1-3H,4H2,(H,15,16)

InChI Key:

LEEJDIOLWLQOQP-UHFFFAOYSA-N

SMILES:

OC(=O)c1ccc2c(c1)nc(o2)CC(F)(F)F

Complexity:

308

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

245.03g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

245.157g/mol

Monoisotopic Mass:

245.03g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

63.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.7