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73096-40-9 | 5-(2-Iodophenyl)-1H-tetrazole , 98%
CAS No: 73096-40-9 Catalog No: AG003M3W MDL No:MFCD07779116
Product Description
Catalog Number:
AG003M3W
Chemical Name:
5-(2-Iodophenyl)-1H-tetrazole , 98%
CAS Number:
73096-40-9
Molecular Formula:
C7H5IN4
Molecular Weight:
272.0459
MDL Number:
MFCD07779116
IUPAC Name:
5-(2-iodophenyl)-2H-tetrazole
InChI:
InChI=1S/C7H5IN4/c8-6-4-2-1-3-5(6)7-9-11-12-10-7/h1-4H,(H,9,10,11,12)
InChI Key:
BISBCDUUTDMGBR-UHFFFAOYSA-N
SMILES:
Ic1ccccc1c1n[nH]nn1
Properties
Complexity:
154
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
271.956g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
272.049g/mol
Monoisotopic Mass:
271.956g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
54.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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