200,000+ products from a single source!
sales@angenechem.com
144434-96-8 | Bicyclo[3.3.1]non-6-ene-3-carboxylic acid, 2,2,2-trifluoroethyl ester
CAS No: 144434-96-8 Catalog No: AG001JJA MDL No:
Product Description
Catalog Number:
AG001JJA
Chemical Name:
Bicyclo[3.3.1]non-6-ene-3-carboxylic acid, 2,2,2-trifluoroethyl ester
CAS Number:
144434-96-8
Molecular Formula:
C12H15F3O2
Molecular Weight:
248.2415
IUPAC Name:
2,2,2-trifluoroethyl bicyclo[3.3.1]non-6-ene-3-carboxylate
InChI:
InChI=1S/C12H15F3O2/c13-12(14,15)7-17-11(16)10-5-8-2-1-3-9(4-8)6-10/h1-2,8-10H,3-7H2
InChI Key:
UFDBSLLCZYTQCJ-UHFFFAOYSA-N
SMILES:
O=C(C1CC2CC=CC(C1)C2)OCC(F)(F)F
Properties
Complexity:
322
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
248.102g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
248.245g/mol
Monoisotopic Mass:
248.102g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.