Home Halogens 5-((2,4-Dichlorobenzyl)thio)-1,3,4-thiadiazole-2-thiol

5-((2,4-Dichlorobenzyl)thio)-1,3,4-thiadiazole-2-thiol

CAS No.:
136384-19-5
Catalog Number:
AG0011T9
Molecular Formula:
C9H6Cl2N2S3
Molecular Weight:
309.2583
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
1 week
United States
$288
- +
250mg
1 week
United States
$389
- +
1g
1 week
United States
$728
- +
Product Description
Catalog Number:
AG0011T9
Chemical Name:
5-((2,4-Dichlorobenzyl)thio)-1,3,4-thiadiazole-2-thiol
CAS Number:
136384-19-5
Molecular Formula:
C9H6Cl2N2S3
Molecular Weight:
309.2583
MDL Number:
MFCD02946288
IUPAC Name:
5-[(2,4-dichlorophenyl)methylsulfanyl]-3H-1,3,4-thiadiazole-2-thione
InChI:
InChI=1S/C9H6Cl2N2S3/c10-6-2-1-5(7(11)3-6)4-15-9-13-12-8(14)16-9/h1-3H,4H2,(H,12,14)
InChI Key:
XPKHYWRIWANKDK-UHFFFAOYSA-N
SMILES:
Clc1ccc(c(c1)Cl)CSc1n[nH]c(=S)s1
Properties
Complexity:
311  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
307.907g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
309.241g/mol
Monoisotopic Mass:
307.907g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
107A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.6  
Properties