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Home > Other Heterocycles > 1250695-37-4
1250695-37-4 | 2-{2-azabicyclo[2.2.1]heptan-2-yl}aniline
CAS No: 1250695-37-4 Catalog No: AG01BG4U MDL No:MFCD14693885
Product Description
Catalog Number:
AG01BG4U
Chemical Name:
2-{2-azabicyclo[2.2.1]heptan-2-yl}aniline
CAS Number:
1250695-37-4
Molecular Formula:
C12H16N2
Molecular Weight:
188.2688
MDL Number:
MFCD14693885
IUPAC Name:
2-(2-azabicyclo[2.2.1]heptan-2-yl)aniline
InChI:
InChI=1S/C12H16N2/c13-11-3-1-2-4-12(11)14-8-9-5-6-10(14)7-9/h1-4,9-10H,5-8,13H2
InChI Key:
XICKTEWTIROYKS-UHFFFAOYSA-N
SMILES:
Nc1ccccc1N1CC2CC1CC2
Properties
Complexity:
216
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.131g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
188.274g/mol
Monoisotopic Mass:
188.131g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
29.3A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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