Name: Name:3-(trifluoromethyl)-7-oxabicyclo[2.2.1]heptane-2-carboxylic acid
Brand: Angene
SKU: AG01ABRJ
Rating: 90 (10 reviews)

3-(trifluoromethyl)-7-oxabicyclo[2.2.1]heptane-2-carboxylic acid

CAS No.:

1797367-92-0

Catalog Number:

AG01ABRJ

Molecular Formula:

C8H9F3O3

Molecular Weight:

210.1505

Catalog Number:

AG01ABRJ

Chemical Name:

3-(trifluoromethyl)-7-oxabicyclo[2.2.1]heptane-2-carboxylic acid

CAS Number:

1797367-92-0

Molecular Formula:

C8H9F3O3

Molecular Weight:

210.1505

MDL Number:

MFCD27959347

IUPAC Name:

3-(trifluoromethyl)-7-oxabicyclo[2.2.1]heptane-2-carboxylic acid

InChI:

InChI=1S/C8H9F3O3/c9-8(10,11)6-4-2-1-3(14-4)5(6)7(12)13/h3-6H,1-2H2,(H,12,13)

InChI Key:

AUZBEXWVMFBWAT-UHFFFAOYSA-N

SMILES:

OC(=O)C1C2CCC(C1C(F)(F)F)O2

Complexity:

263

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

210.05g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

210.152g/mol

Monoisotopic Mass:

210.05g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

46.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.4