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139476-73-6 | 2H-Tetrazol-5-amine, 2-dodecyl-
CAS No: 139476-73-6 Catalog No: AG001B3E MDL No:
Product Description
Catalog Number:
AG001B3E
Chemical Name:
2H-Tetrazol-5-amine, 2-dodecyl-
CAS Number:
139476-73-6
Molecular Formula:
C13H27N5
Molecular Weight:
253.3870
IUPAC Name:
2-dodecyltetrazol-5-amine
InChI:
InChI=1S/C13H27N5/c1-2-3-4-5-6-7-8-9-10-11-12-18-16-13(14)15-17-18/h2-12H2,1H3,(H2,14,16)
InChI Key:
GMWLXVMVRUKTRS-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCn1nnc(n1)N
Properties
Complexity:
188
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
253.227g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
253.394g/mol
Monoisotopic Mass:
253.227g/mol
Rotatable Bond Count:
11
Topological Polar Surface Area:
69.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.3
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