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141651-20-9 | 1H-Tetrazole, 1-ethenyl-5-iodo-
CAS No: 141651-20-9 Catalog No: AG007Z7D MDL No:
Product Description
Catalog Number:
AG007Z7D
Chemical Name:
1H-Tetrazole, 1-ethenyl-5-iodo-
CAS Number:
141651-20-9
Molecular Formula:
C3H3IN4
Molecular Weight:
221.9872
IUPAC Name:
1-ethenyl-5-iodotetrazole
InChI:
InChI=1S/C3H3IN4/c1-2-8-3(4)5-6-7-8/h2H,1H2
InChI Key:
DKVBJDSYGOIZEL-UHFFFAOYSA-N
SMILES:
C=Cn1nnnc1I
Properties
Complexity:
95.3
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.94g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
221.989g/mol
Monoisotopic Mass:
221.94g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
43.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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