Home Other Building Blocks 1-(4-Ethoxyphenyl)-1H-tetrazole-5-thiol

1-(4-Ethoxyphenyl)-1H-tetrazole-5-thiol

CAS No.:
15182-68-0
Catalog Number:
AG003CZ7
Molecular Formula:
C9H10N4OS
Molecular Weight:
222.2669
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
>98.0%(HPLC)
1 week
United States
$221
- +
Product Description
Catalog Number:
AG003CZ7
Chemical Name:
1-(4-Ethoxyphenyl)-1H-tetrazole-5-thiol
CAS Number:
15182-68-0
Molecular Formula:
C9H10N4OS
Molecular Weight:
222.2669
MDL Number:
MFCD02252889
IUPAC Name:
1-(4-ethoxyphenyl)-2H-tetrazole-5-thione
InChI:
InChI=1S/C9H10N4OS/c1-2-14-8-5-3-7(4-6-8)13-9(15)10-11-12-13/h3-6H,2H2,1H3,(H,10,12,15)
InChI Key:
ASFXKDBHBVHSLT-UHFFFAOYSA-N
SMILES:
CCOc1ccc(cc1)n1nnnc1S
Properties
Complexity:
263  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.058g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
222.266g/mol
Monoisotopic Mass:
222.058g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
81.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2  
Properties