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1123-99-5 | 2-Iodobenzo[d]thiazole
CAS No: 1123-99-5 Catalog No: AG0082NZ MDL No:MFCD00971971
Product Description
Catalog Number:
AG0082NZ
Chemical Name:
2-Iodobenzo[d]thiazole
CAS Number:
1123-99-5
Molecular Formula:
C7H4INS
Molecular Weight:
261.0828
MDL Number:
MFCD00971971
IUPAC Name:
2-iodo-1,3-benzothiazole
InChI:
InChI=1S/C7H4INS/c8-7-9-5-3-1-2-4-6(5)10-7/h1-4H
InChI Key:
WTKCRPLRJZZCMJ-UHFFFAOYSA-N
SMILES:
Ic1nc2c(s1)cccc2
Properties
Complexity:
131
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
260.911g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
261.08g/mol
Monoisotopic Mass:
260.911g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
41.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
Literature
| Title | Journal |
|---|---|
| Synthesis of macrocyclic, potential protease inhibitors using a generic scaffold. | The Journal of organic chemistry 20020712 |
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