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Home > Other Heterocycles > 1861773-14-9
1861773-14-9 | 1-phenyl-2-azaspiro[3.4]octane
CAS No: 1861773-14-9 Catalog No: AG01C29H MDL No:MFCD28134182
Product Description
Catalog Number:
AG01C29H
Chemical Name:
1-phenyl-2-azaspiro[3.4]octane
CAS Number:
1861773-14-9
Molecular Formula:
C13H17N
Molecular Weight:
187.2808
MDL Number:
MFCD28134182
IUPAC Name:
3-phenyl-2-azaspiro[3.4]octane
InChI:
InChI=1S/C13H17N/c1-2-6-11(7-3-1)12-13(10-14-12)8-4-5-9-13/h1-3,6-7,12,14H,4-5,8-10H2
InChI Key:
XEVSADJJDHDHGO-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)C1NCC21CCCC2
Properties
Complexity:
199
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
187.136g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
187.286g/mol
Monoisotopic Mass:
187.136g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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