200,000+ products from a single source!
sales@angenechem.com
Home > Thiazole > 1354951-94-2
1354951-94-2 | 3-[(2-methyl-1,3-thiazol-5-yl)methyl]benzoic acid hydrochloride
CAS No: 1354951-94-2 Catalog No: AG019T4E MDL No:MFCD20731211
Product Description
Catalog Number:
AG019T4E
Chemical Name:
3-[(2-methyl-1,3-thiazol-5-yl)methyl]benzoic acid hydrochloride
CAS Number:
1354951-94-2
Molecular Formula:
C12H12ClNO2S
Molecular Weight:
269.7472
MDL Number:
MFCD20731211
IUPAC Name:
3-[(2-methyl-1,3-thiazol-5-yl)methyl]benzoic acid;hydrochloride
InChI:
InChI=1S/C12H11NO2S.ClH/c1-8-13-7-11(16-8)6-9-3-2-4-10(5-9)12(14)15;/h2-5,7H,6H2,1H3,(H,14,15);1H
InChI Key:
KORSDNMEDVBTBZ-UHFFFAOYSA-N
SMILES:
Cc1ncc(s1)Cc1cccc(c1)C(=O)O.Cl
Properties
Complexity:
259
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
269.028g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
269.743g/mol
Monoisotopic Mass:
269.028g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
78.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.