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Home > Other Heterocycles > 1639447-80-5
1639447-80-5 | 1,2,6-triazaspiro[2.6]non-1-ene
CAS No: 1639447-80-5 Catalog No: AG01AM8F MDL No:MFCD29033898
Product Description
Catalog Number:
AG01AM8F
Chemical Name:
1,2,6-triazaspiro[2.6]non-1-ene
CAS Number:
1639447-80-5
Molecular Formula:
C6H11N3
Molecular Weight:
125.1716
MDL Number:
MFCD29033898
IUPAC Name:
1,2,7-triazaspiro[2.6]non-1-ene
InChI:
InChI=1S/C6H11N3/c1-2-6(8-9-6)3-5-7-4-1/h7H,1-5H2
InChI Key:
KDQRQCFJODHAHY-UHFFFAOYSA-N
SMILES:
N1CCCC2(CC1)N=N2
Properties
Complexity:
135
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
125.095g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
125.175g/mol
Monoisotopic Mass:
125.095g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
36.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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