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Home > Other Heterocycles > 2060028-59-1
2060028-59-1 | 3-{6-azaspiro[3.4]octan-8-yl}phenol
CAS No: 2060028-59-1 Catalog No: AG01BYIY MDL No:MFCD30486926
Product Description
Catalog Number:
AG01BYIY
Chemical Name:
3-{6-azaspiro[3.4]octan-8-yl}phenol
CAS Number:
2060028-59-1
Molecular Formula:
C13H17NO
Molecular Weight:
203.2802
MDL Number:
MFCD30486926
IUPAC Name:
3-(6-azaspiro[3.4]octan-8-yl)phenol
InChI:
InChI=1S/C13H17NO/c15-11-4-1-3-10(7-11)12-8-14-9-13(12)5-2-6-13/h1,3-4,7,12,14-15H,2,5-6,8-9H2
InChI Key:
WWTJZHIBWJYUMO-UHFFFAOYSA-N
SMILES:
Oc1cccc(c1)C1CNCC21CCC2
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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