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832112-58-0 | 1,2,4,5-Tetrazin-3-amine, 6-(1,1-dimethylethyl)-N-ethyl-2,3-dihydro-
CAS No: 832112-58-0 Catalog No: AG004ZCR MDL No:
Product Description
Catalog Number:
AG004ZCR
Chemical Name:
1,2,4,5-Tetrazin-3-amine, 6-(1,1-dimethylethyl)-N-ethyl-2,3-dihydro-
CAS Number:
832112-58-0
Molecular Formula:
C8H17N5
Molecular Weight:
183.2541
IUPAC Name:
3-tert-butyl-N-ethyl-1,6-dihydro-1,2,4,5-tetrazin-6-amine
InChI:
InChI=1S/C8H17N5/c1-5-9-7-12-10-6(11-13-7)8(2,3)4/h7,9,12H,5H2,1-4H3
InChI Key:
ICPWKNNSLPRTCZ-UHFFFAOYSA-N
SMILES:
CCNC1NN=C(N=N1)C(C)(C)C
Properties
Complexity:
225
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
183.148g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
183.259g/mol
Monoisotopic Mass:
183.148g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
61.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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