200,000+ products from a single source!
sales@angenechem.com
46719-49-7 | Thiazolium,5-(2-hydroxyethyl)-4-methyl-3-(phenylmethyl)-
CAS No: 46719-49-7 Catalog No: AG007218 MDL No:MFCD01037133
Product Description
Catalog Number:
AG007218
Chemical Name:
Thiazolium,5-(2-hydroxyethyl)-4-methyl-3-(phenylmethyl)-
CAS Number:
46719-49-7
Molecular Formula:
C13H16NOS+
Molecular Weight:
234.3372
MDL Number:
MFCD01037133
IUPAC Name:
2-(3-benzyl-4-methyl-1,3-thiazol-3-ium-5-yl)ethanol
InChI:
InChI=1S/C13H16NOS/c1-11-13(7-8-15)16-10-14(11)9-12-5-3-2-4-6-12/h2-6,10,15H,7-9H2,1H3/q+1
InChI Key:
KFFCZLRCIKDJRE-UHFFFAOYSA-N
SMILES:
OCCc1sc[n+](c1C)Cc1ccccc1
Properties
Complexity:
206
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.095g/mol
Formal Charge:
1
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
234.337g/mol
Monoisotopic Mass:
234.095g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
52.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.