Home Other Building Blocks 2-fluoro-4-(1H-tetrazol-5-yl)benzoic acid

2-fluoro-4-(1H-tetrazol-5-yl)benzoic acid

CAS No.:
1281983-77-4
Catalog Number:
AG01DV6N
Molecular Formula:
C8H5FN4O2
Molecular Weight:
208.1493
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01DV6N
Chemical Name:
2-fluoro-4-(1H-tetrazol-5-yl)benzoic acid
CAS Number:
1281983-77-4
Molecular Formula:
C8H5FN4O2
Molecular Weight:
208.1493
MDL Number:
MFCD24485317
IUPAC Name:
2-fluoro-4-(2H-tetrazol-5-yl)benzoic acid
InChI:
InChI=1S/C8H5FN4O2/c9-6-3-4(7-10-12-13-11-7)1-2-5(6)8(14)15/h1-3H,(H,14,15)(H,10,11,12,13)
InChI Key:
WZADURDEXDTRDQ-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccc(cc1F)c1nnn[nH]1
Properties
Complexity:
253  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.04g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
208.152g/mol
Monoisotopic Mass:
208.04g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
91.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8  
Properties