200,000+ products from a single source!
sales@angenechem.com
120194-97-0 | Benzothiazole, 6-isothiocyanato-5-methyl- (9CI)
CAS No: 120194-97-0 Catalog No: AG008YQK MDL No:
Product Description
Catalog Number:
AG008YQK
Chemical Name:
Benzothiazole, 6-isothiocyanato-5-methyl- (9CI)
CAS Number:
120194-97-0
IUPAC Name:
6-isothiocyanato-5-methyl-1,3-benzothiazole
InChI:
InChI=1S/C9H6N2S2/c1-6-2-8-9(13-5-11-8)3-7(6)10-4-12/h2-3,5H,1H3
InChI Key:
CTTAUBDXYQFERF-UHFFFAOYSA-N
Properties
Complexity:
238
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
205.997g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
206.281g/mol
Monoisotopic Mass:
205.997g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
85.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.