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151451-83-1 | 4-iodo-1-phenyl-1H-1,2,3-triazole
CAS No: 151451-83-1 Catalog No: AG01ELCG MDL No:MFCD29086869
Product Description
Catalog Number:
AG01ELCG
Chemical Name:
4-iodo-1-phenyl-1H-1,2,3-triazole
CAS Number:
151451-83-1
Molecular Formula:
C8H6IN3
Molecular Weight:
271.0578
MDL Number:
MFCD29086869
IUPAC Name:
4-iodo-1-phenyltriazole
InChI:
InChI=1S/C8H6IN3/c9-8-6-12(11-10-8)7-4-2-1-3-5-7/h1-6H
InChI Key:
NEFAQUVHKDSMCE-UHFFFAOYSA-N
SMILES:
Ic1nnn(c1)c1ccccc1
Properties
Complexity:
147
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
270.961g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
271.061g/mol
Monoisotopic Mass:
270.961g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
30.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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