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1196152-14-3 | 2-chloro-4-(1H-tetrazol-5-yl)pyridine
CAS No: 1196152-14-3 Catalog No: AG01FLYW MDL No:MFCD10696104
Product Description
Catalog Number:
AG01FLYW
Chemical Name:
2-chloro-4-(1H-tetrazol-5-yl)pyridine
CAS Number:
1196152-14-3
Molecular Formula:
C6H4ClN5
Molecular Weight:
181.5825
MDL Number:
MFCD10696104
IUPAC Name:
2-chloro-4-(2H-tetrazol-5-yl)pyridine
InChI:
InChI=1S/C6H4ClN5/c7-5-3-4(1-2-8-5)6-9-11-12-10-6/h1-3H,(H,9,10,11,12)
InChI Key:
KUXZJLQJVCDQRG-UHFFFAOYSA-N
SMILES:
Clc1nccc(c1)c1nnn[nH]1
Properties
Complexity:
155
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
181.016g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
181.583g/mol
Monoisotopic Mass:
181.016g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
67.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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