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33452-18-5 | 5-iodo-1-methyl-1H-tetrazole
CAS No: 33452-18-5 Catalog No: AG00C8ZC MDL No:MFCD12827507
Product Description
Catalog Number:
AG00C8ZC
Chemical Name:
5-iodo-1-methyl-1H-tetrazole
CAS Number:
33452-18-5
Molecular Formula:
C2H3IN4
Molecular Weight:
209.9765
MDL Number:
MFCD12827507
IUPAC Name:
5-iodo-1-methyltetrazole
InChI:
InChI=1S/C2H3IN4/c1-7-2(3)4-5-6-7/h1H3
InChI Key:
HOTGKPZHBAAUIM-UHFFFAOYSA-N
SMILES:
Cn1nnnc1I
Properties
Complexity:
66.7
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
209.94g/mol
Formal Charge:
0
Heavy Atom Count:
7
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
209.978g/mol
Monoisotopic Mass:
209.94g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
43.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
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