200,000+ products from a single source!
sales@angenechem.com
130089-08-6 | [1,1'-Biphenyl]-4-carboxylic acid, 3'-fluoro-4'-(hexyloxy)-
CAS No: 130089-08-6 Catalog No: AG000TZS MDL No:
Product Description
Catalog Number:
AG000TZS
Chemical Name:
[1,1'-Biphenyl]-4-carboxylic acid, 3'-fluoro-4'-(hexyloxy)-
CAS Number:
130089-08-6
Molecular Formula:
C19H21FO3
Molecular Weight:
316.3666
IUPAC Name:
4-(3-fluoro-4-hexoxyphenyl)benzoic acid
InChI:
InChI=1S/C19H21FO3/c1-2-3-4-5-12-23-18-11-10-16(13-17(18)20)14-6-8-15(9-7-14)19(21)22/h6-11,13H,2-5,12H2,1H3,(H,21,22)
InChI Key:
TYXINVPAGHYZLZ-UHFFFAOYSA-N
SMILES:
CCCCCCOc1ccc(cc1F)c1ccc(cc1)C(=O)O
Properties
Complexity:
353
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
316.147g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
316.372g/mol
Monoisotopic Mass:
316.147g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.5
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.