200,000+ products from a single source!
sales@angenechem.com
Home > Carboxes > 1261944-34-6
1261944-34-6 | [1,1'-Biphenyl]-4-carboxylic acid, 3-fluoro-4'-(methylthio)-
CAS No: 1261944-34-6 Catalog No: AG000S85 MDL No:MFCD18320526
Product Description
Catalog Number:
AG000S85
Chemical Name:
[1,1'-Biphenyl]-4-carboxylic acid, 3-fluoro-4'-(methylthio)-
CAS Number:
1261944-34-6
Molecular Formula:
C14H11FO2S
Molecular Weight:
262.2993
MDL Number:
MFCD18320526
IUPAC Name:
2-fluoro-4-(4-methylsulfanylphenyl)benzoic acid
InChI:
InChI=1S/C14H11FO2S/c1-18-11-5-2-9(3-6-11)10-4-7-12(14(16)17)13(15)8-10/h2-8H,1H3,(H,16,17)
InChI Key:
QHLAMQHFOKXKMB-UHFFFAOYSA-N
SMILES:
CSc1ccc(cc1)c1ccc(c(c1)F)C(=O)O
Properties
Complexity:
290
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
262.046g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
262.298g/mol
Monoisotopic Mass:
262.046g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
62.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.