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Home > Other Heterocycles > 148672-76-8
148672-76-8 | {1-azabicyclo[3.3.1]nonan-5-yl}methanol
CAS No: 148672-76-8 Catalog No: AG01BXG2 MDL No:MFCD30497674
Product Description
Catalog Number:
AG01BXG2
Chemical Name:
{1-azabicyclo[3.3.1]nonan-5-yl}methanol
CAS Number:
148672-76-8
Molecular Formula:
C9H17NO
Molecular Weight:
155.2374
MDL Number:
MFCD30497674
IUPAC Name:
1-azabicyclo[3.3.1]nonan-5-ylmethanol
InChI:
InChI=1S/C9H17NO/c11-8-9-3-1-5-10(7-9)6-2-4-9/h11H,1-8H2
InChI Key:
QKPOFVXKUKGCEP-UHFFFAOYSA-N
SMILES:
OCC12CCCN(C2)CCC1
Properties
Complexity:
137
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
155.131g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
155.241g/mol
Monoisotopic Mass:
155.131g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
23.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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