200,000+ products from a single source!
sales@angenechem.com
155596-89-7 | 2(3H)-Benzothiazolethione, 4-bromo-6-methyl-
CAS No: 155596-89-7 Catalog No: AG001O0C MDL No:MFCD15143551
Product Description
Catalog Number:
AG001O0C
Chemical Name:
2(3H)-Benzothiazolethione, 4-bromo-6-methyl-
CAS Number:
155596-89-7
Molecular Formula:
C8H6BrNS2
Molecular Weight:
260.1739
MDL Number:
MFCD15143551
IUPAC Name:
4-bromo-6-methyl-3H-1,3-benzothiazole-2-thione
InChI:
InChI=1S/C8H6BrNS2/c1-4-2-5(9)7-6(3-4)12-8(11)10-7/h2-3H,1H3,(H,10,11)
InChI Key:
NTFRCPCWLQNGLF-UHFFFAOYSA-N
SMILES:
Cc1cc2sc(=S)[nH]c2c(c1)Br
Properties
Complexity:
209
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
258.913g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
260.167g/mol
Monoisotopic Mass:
258.913g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
69.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.