Home Other Building Blocks Benzenemethanol, 3-(2H-tetrazol-5-yl)-

Benzenemethanol, 3-(2H-tetrazol-5-yl)-

CAS No.:
179057-20-6
Catalog Number:
AG0026QL
Molecular Formula:
C8H8N4O
Molecular Weight:
176.1753
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG0026QL
Chemical Name:
Benzenemethanol, 3-(2H-tetrazol-5-yl)-
CAS Number:
179057-20-6
Molecular Formula:
C8H8N4O
Molecular Weight:
176.1753
MDL Number:
MFCD09864536
IUPAC Name:
[3-(2H-tetrazol-5-yl)phenyl]methanol
InChI:
InChI=1S/C8H8N4O/c13-5-6-2-1-3-7(4-6)8-9-11-12-10-8/h1-4,13H,5H2,(H,9,10,11,12)
InChI Key:
YGESRLFHDANLIL-UHFFFAOYSA-N
SMILES:
OCc1cccc(c1)c1n[nH]nn1
Properties
Complexity:
166  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
176.07g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
176.179g/mol
Monoisotopic Mass:
176.07g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
74.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2  
Properties