200,000+ products from a single source!
sales@angenechem.com
18902-93-7 | Benzoic acid, 2-[[3-(methylthio)phenyl]amino]-
CAS No: 18902-93-7 Catalog No: AG002HQ4 MDL No:
Product Description
Catalog Number:
AG002HQ4
Chemical Name:
Benzoic acid, 2-[[3-(methylthio)phenyl]amino]-
CAS Number:
18902-93-7
Molecular Formula:
C14H13NO2S
Molecular Weight:
259.3235
IUPAC Name:
2-(3-methylsulfanylanilino)benzoic acid
InChI:
InChI=1S/C14H13NO2S/c1-18-11-6-4-5-10(9-11)15-13-8-3-2-7-12(13)14(16)17/h2-9,15H,1H3,(H,16,17)
InChI Key:
JLVZKULKBLUFIY-UHFFFAOYSA-N
SMILES:
CSc1cccc(c1)Nc1ccccc1C(=O)O
Properties
Complexity:
285
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
259.067g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
259.323g/mol
Monoisotopic Mass:
259.067g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
74.6A^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.