Benzoic acid, 4-(1H-tetrazol-5-yl)-


Chemical Name: Benzoic acid, 4-(1H-tetrazol-5-yl)-
CAS Number: 34114-12-0
Product Number: AG0033SI(AGN-PC-0O93UY)
Synonyms:
MDL No: MFCD06345720
Molecular Formula: C8H6N4O2
Molecular Weight: 190.1588

Identification/Properties


Properties
MP:
248-250°C
BP:
467.5°C at 760 mmHg
Storage:
Inert atmosphere;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
190.162g/mol
XLogP3:
0.7
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
2
Exact Mass:
190.049g/mol
Monoisotopic Mass:
190.049g/mol
Topological Polar Surface Area:
91.8A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
215
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


Request for Quotation


Customer Feedback