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2060036-97-5

2060036-97-5 | 4-(3-hydroxyphenyl)-2-azaspiro[4.4]nonan-1-one

CAS No: 2060036-97-5 Catalog No: AG01BZV5 MDL No:MFCD30486885

Product Description

Catalog Number:
AG01BZV5
Chemical Name:
4-(3-hydroxyphenyl)-2-azaspiro[4.4]nonan-1-one
CAS Number:
2060036-97-5
Molecular Formula:
C14H17NO2
Molecular Weight:
231.2903
MDL Number:
MFCD30486885
IUPAC Name:
4-(3-hydroxyphenyl)-2-azaspiro[4.4]nonan-1-one
InChI:
InChI=1S/C14H17NO2/c16-11-5-3-4-10(8-11)12-9-15-13(17)14(12)6-1-2-7-14/h3-5,8,12,16H,1-2,6-7,9H2,(H,15,17)
InChI Key:
QPTUPJBBIFOJKE-UHFFFAOYSA-N
SMILES:
Oc1cccc(c1)C1CNC(=O)C21CCCC2

Properties

Complexity:
309  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
231.126g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
231.295g/mol
Monoisotopic Mass:
231.126g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
49.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  

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