200,000+ products from a single source!
sales@angenechem.com
24793-01-9 | Acetonitrile, (2-benzothiazolylthio)- (8CI,9CI)
CAS No: 24793-01-9 Catalog No: AG00BK8I MDL No:MFCD00104617
Product Description
Catalog Number:
AG00BK8I
Chemical Name:
Acetonitrile, (2-benzothiazolylthio)- (8CI,9CI)
CAS Number:
24793-01-9
Molecular Formula:
C9H6N2S2
Molecular Weight:
206.2873
MDL Number:
MFCD00104617
IUPAC Name:
2-(1,3-benzothiazol-2-ylsulfanyl)acetonitrile
InChI:
InChI=1S/C9H6N2S2/c10-5-6-12-9-11-7-3-1-2-4-8(7)13-9/h1-4H,6H2
InChI Key:
GWSJKSFGUSSSKQ-UHFFFAOYSA-N
SMILES:
N#CCSc1nc2c(s1)cccc2
Properties
Complexity:
223
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:
2
Topological Polar Surface Area:
90.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
Literature
| Title | Journal |
|---|---|
| Synthesis and E/Z configuration determination of novel derivatives of 3-aryl-2-(benzothiazol-2'-ylthio) acrylonitrile, 3-(benzothiazol-2'-ylthio)-4-(furan-2''-yl)-3-buten-2-one and 2-(1-(furan-2''-yl)-3'-oxobut-1''-en-2-ylthio)-3-phenylquinazolin-4(3H)-one. | Molecules (Basel, Switzerland) 20110720 |
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.