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123366-50-7 | 1H-Tetrazole, 1-ethyl-5-iodo-
CAS No: 123366-50-7 Catalog No: AG000KGI MDL No:
Product Description
Catalog Number:
AG000KGI
Chemical Name:
1H-Tetrazole, 1-ethyl-5-iodo-
CAS Number:
123366-50-7
Molecular Formula:
C3H5IN4
Molecular Weight:
224.0031
IUPAC Name:
1-ethyl-5-iodotetrazole
InChI:
InChI=1S/C3H5IN4/c1-2-8-3(4)5-6-7-8/h2H2,1H3
InChI Key:
ZEJSYASQYGPZNY-UHFFFAOYSA-N
SMILES:
CCn1nnnc1I
Properties
Complexity:
77.7
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
223.956g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
224.005g/mol
Monoisotopic Mass:
223.956g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
43.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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