Name: Name:2H-1-Benzopyran-3-carboxylic acid, 2-(trifluoromethyl)-
Brand: Angene
SKU: AG007110
Rating: 90 (10 reviews)

2H-1-Benzopyran-3-carboxylic acid, 2-(trifluoromethyl)-

CAS No.:

215122-16-0

Catalog Number:

AG007110

Molecular Formula:

C11H7F3O3

Molecular Weight:

244.1667

Catalog Number:

AG007110

Chemical Name:

2H-1-Benzopyran-3-carboxylic acid, 2-(trifluoromethyl)-

CAS Number:

215122-16-0

Molecular Formula:

C11H7F3O3

Molecular Weight:

244.1667

MDL Number:

MFCD30345187

IUPAC Name:

2-(trifluoromethyl)-2H-chromene-3-carboxylic acid

InChI:

InChI=1S/C11H7F3O3/c12-11(13,14)9-7(10(15)16)5-6-3-1-2-4-8(6)17-9/h1-5,9H,(H,15,16)

InChI Key:

QSLSQLYQCKEGMS-UHFFFAOYSA-N

SMILES:

OC(=O)C1=Cc2ccccc2OC1C(F)(F)F

Complexity:

348

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

244.035g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

244.169g/mol

Monoisotopic Mass:

244.035g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

46.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.6