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Home > Other Heterocycles > 2060005-86-7
2060005-86-7 | 3-{2-azaspiro[4.4]nonan-4-yl}phenol
CAS No: 2060005-86-7 Catalog No: AG01BYKB MDL No:MFCD30486965
Product Description
Catalog Number:
AG01BYKB
Chemical Name:
3-{2-azaspiro[4.4]nonan-4-yl}phenol
CAS Number:
2060005-86-7
Molecular Formula:
C14H19NO
Molecular Weight:
217.3068
MDL Number:
MFCD30486965
IUPAC Name:
3-(2-azaspiro[4.4]nonan-4-yl)phenol
InChI:
InChI=1S/C14H19NO/c16-12-5-3-4-11(8-12)13-9-15-10-14(13)6-1-2-7-14/h3-5,8,13,15-16H,1-2,6-7,9-10H2
InChI Key:
NUYYUCXDBQSYAQ-UHFFFAOYSA-N
SMILES:
Oc1cccc(c1)C1CNCC21CCCC2
Properties
Complexity:
247
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
217.147g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
217.312g/mol
Monoisotopic Mass:
217.147g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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