200,000+ products from a single source!
sales@angenechem.com
94087-78-2 | 2-[[(1,2-BENZISOTHIAZOL-3-YLOXY)METHYL]METHYLAMINO]ETHANOL
CAS No: 94087-78-2 Catalog No: AG006S45 MDL No:
Product Description
Catalog Number:
AG006S45
Chemical Name:
2-[[(1,2-BENZISOTHIAZOL-3-YLOXY)METHYL]METHYLAMINO]ETHANOL
CAS Number:
94087-78-2
Molecular Formula:
C11H14N2O2S
Molecular Weight:
238.3061
IUPAC Name:
2-[1,2-benzothiazol-3-yloxymethyl(methyl)amino]ethanol
InChI:
InChI=1S/C11H14N2O2S/c1-13(6-7-14)8-15-11-9-4-2-3-5-10(9)16-12-11/h2-5,14H,6-8H2,1H3
InChI Key:
NUJYXMDEPJKZDB-UHFFFAOYSA-N
SMILES:
OCCN(COc1nsc2c1cccc2)C
EC Number:
301-972-1
Properties
Complexity:
218
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
238.078g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
238.305g/mol
Monoisotopic Mass:
238.078g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
73.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.