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Home > Other Heterocycles > 86215-38-5
86215-38-5 | 3-Azabicyclo[3.1.0]hexane, 1-(4-hexylphenyl)-
CAS No: 86215-38-5 Catalog No: AG004K2H MDL No:
Product Description
Catalog Number:
AG004K2H
Chemical Name:
3-Azabicyclo[3.1.0]hexane, 1-(4-hexylphenyl)-
CAS Number:
86215-38-5
Molecular Formula:
C17H25N
Molecular Weight:
243.3871
IUPAC Name:
1-(4-hexylphenyl)-3-azabicyclo[3.1.0]hexane
InChI:
InChI=1S/C17H25N/c1-2-3-4-5-6-14-7-9-15(10-8-14)17-11-16(17)12-18-13-17/h7-10,16,18H,2-6,11-13H2,1H3
InChI Key:
VGQVQKHNKNUNQT-UHFFFAOYSA-N
SMILES:
CCCCCCc1ccc(cc1)C12CNCC2C1
Properties
Complexity:
267
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
243.199g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
243.394g/mol
Monoisotopic Mass:
243.199g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
4.7
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