200,000+ products from a single source!
sales@angenechem.com
334501-89-2 | Benzothiazole, 2-[[2-(4-methylphenoxy)ethyl]thio]-
CAS No: 334501-89-2 Catalog No: AG007FDB MDL No:
Product Description
Catalog Number:
AG007FDB
Chemical Name:
Benzothiazole, 2-[[2-(4-methylphenoxy)ethyl]thio]-
CAS Number:
334501-89-2
Molecular Formula:
C16H15NOS2
Molecular Weight:
301.4264
IUPAC Name:
2-[2-(4-methylphenoxy)ethylsulfanyl]-1,3-benzothiazole
InChI:
InChI=1S/C16H15NOS2/c1-12-6-8-13(9-7-12)18-10-11-19-16-17-14-4-2-3-5-15(14)20-16/h2-9H,10-11H2,1H3
InChI Key:
VRZYDZRRRUPXIO-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)OCCSc1nc2c(s1)cccc2
Properties
Complexity:
294
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
301.06g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
301.422g/mol
Monoisotopic Mass:
301.06g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
75.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.4
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.