200,000+ products from a single source!
sales@angenechem.com
130997-66-9 | 2(3H)-Benzothiazolimine, 3-(cyclopropylmethyl)-6-(trifluoromethoxy)-, hydrobromide (1:1)
CAS No: 130997-66-9 Catalog No: AG000V8A MDL No:
Product Description
Catalog Number:
AG000V8A
Chemical Name:
2(3H)-Benzothiazolimine, 3-(cyclopropylmethyl)-6-(trifluoromethoxy)-, hydrobromide (1:1)
CAS Number:
130997-66-9
Molecular Formula:
C12H12BrF3N2OS
Molecular Weight:
369.2007
IUPAC Name:
3-(cyclopropylmethyl)-6-(trifluoromethoxy)-1,3-benzothiazol-2-imine;hydrobromide
InChI:
InChI=1S/C12H11F3N2OS.BrH/c13-12(14,15)18-8-3-4-9-10(5-8)19-11(16)17(9)6-7-1-2-7;/h3-5,7,16H,1-2,6H2;1H
InChI Key:
JYPIFLPNKOTUIN-UHFFFAOYSA-N
SMILES:
N=c1sc2c(n1CC1CC1)ccc(c2)OC(F)(F)F.Br
Properties
Complexity:
373
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
367.981g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
369.2g/mol
Monoisotopic Mass:
367.981g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
61.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.