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Home > Other Heterocycles > 67625-81-4
67625-81-4 | 2-Azaspiro[5.7]tridec-1-ene
CAS No: 67625-81-4 Catalog No: AG006CSG MDL No:
Product Description
Catalog Number:
AG006CSG
Chemical Name:
2-Azaspiro[5.7]tridec-1-ene
CAS Number:
67625-81-4
Molecular Formula:
C12H21N
Molecular Weight:
179.3018
IUPAC Name:
2-azaspiro[5.7]tridec-1-ene
InChI:
InChI=1S/C12H21N/c1-2-4-7-12(8-5-3-1)9-6-10-13-11-12/h11H,1-10H2
InChI Key:
PPOOMEVZMMALDZ-UHFFFAOYSA-N
SMILES:
C1CCCC2(CCC1)CCCN=C2
Properties
Complexity:
176
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
179.167g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
179.307g/mol
Monoisotopic Mass:
179.167g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
12.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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