200,000+ products from a single source!
sales@angenechem.com
Home > Carboxes > 1365988-22-2
1365988-22-2 | 2-(4-Hydroxymethylphenyl)thiophene-3-carboxylic acid
CAS No: 1365988-22-2 Catalog No: AG01F8IS MDL No:
Product Description
Catalog Number:
AG01F8IS
Chemical Name:
2-(4-Hydroxymethylphenyl)thiophene-3-carboxylic acid
CAS Number:
1365988-22-2
Molecular Formula:
C12H10O3S
Molecular Weight:
234.2710
IUPAC Name:
2-[4-(hydroxymethyl)phenyl]thiophene-3-carboxylic acid
InChI:
InChI=1S/C12H10O3S/c13-7-8-1-3-9(4-2-8)11-10(12(14)15)5-6-16-11/h1-6,13H,7H2,(H,14,15)
InChI Key:
PIFRZCJCXICBIA-UHFFFAOYSA-N
SMILES:
OCc1ccc(cc1)c1sccc1C(=O)O
Properties
Complexity:
249
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.035g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
234.269g/mol
Monoisotopic Mass:
234.035g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
85.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
Related Products
© 2019 Angene International Limited. All rights Reserved.