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Home > Other Heterocycles > 2059955-45-0
2059955-45-0 | 2-{6-azaspiro[3.4]octan-8-yl}phenol
CAS No: 2059955-45-0 Catalog No: AG01BYIP MDL No:MFCD30486758
Product Description
Catalog Number:
AG01BYIP
Chemical Name:
2-{6-azaspiro[3.4]octan-8-yl}phenol
CAS Number:
2059955-45-0
Molecular Formula:
C13H17NO
Molecular Weight:
203.2802
MDL Number:
MFCD30486758
IUPAC Name:
2-(6-azaspiro[3.4]octan-8-yl)phenol
InChI:
InChI=1S/C13H17NO/c15-12-5-2-1-4-10(12)11-8-14-9-13(11)6-3-7-13/h1-2,4-5,11,14-15H,3,6-9H2
InChI Key:
PINXMZDRIKYQRD-UHFFFAOYSA-N
SMILES:
Oc1ccccc1C1CNCC21CCC2
Properties
Complexity:
237
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
203.131g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
203.285g/mol
Monoisotopic Mass:
203.131g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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