Home Other Building Blocks 2-Mercapto-5-phenylbenzoxazole

2-Mercapto-5-phenylbenzoxazole

CAS No.:
17371-99-2
Catalog Number:
AG001Z4V
Molecular Formula:
C13H9NOS
Molecular Weight:
227.2817
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
>98.0%(GC)(T)
1 week
United States
$153
- +
5g
>98.0%(GC)(T)
1 week
United States
$441
- +
Product Description
Catalog Number:
AG001Z4V
Chemical Name:
2-Mercapto-5-phenylbenzoxazole
CAS Number:
17371-99-2
Molecular Formula:
C13H9NOS
Molecular Weight:
227.2817
MDL Number:
MFCD00022847
IUPAC Name:
5-phenyl-3H-1,3-benzoxazole-2-thione
InChI:
InChI=1S/C13H9NOS/c16-13-14-11-8-10(6-7-12(11)15-13)9-4-2-1-3-5-9/h1-8H,(H,14,16)
InChI Key:
QKLMWNVNJBXKRG-UHFFFAOYSA-N
SMILES:
S=c1oc2c([nH]1)cc(cc2)c1ccccc1
NSC Number:
93817
Properties
Complexity:
275  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
227.04g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
227.281g/mol
Monoisotopic Mass:
227.04g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
53.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4  
Literature
Title Journal
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501
Properties