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Home > Other Heterocycles > 1204875-03-5
1204875-03-5 | 5-Benzyl-5-azaspiro[2.4]heptane
CAS No: 1204875-03-5 Catalog No: AG0075YT MDL No:MFCD21099572
Product Description
Catalog Number:
AG0075YT
Chemical Name:
5-Benzyl-5-azaspiro[2.4]heptane
CAS Number:
1204875-03-5
Molecular Formula:
C13H17N
Molecular Weight:
187.2808
MDL Number:
MFCD21099572
IUPAC Name:
5-benzyl-5-azaspiro[2.4]heptane
InChI:
InChI=1S/C13H17N/c1-2-4-12(5-3-1)10-14-9-8-13(11-14)6-7-13/h1-5H,6-11H2
InChI Key:
NDJMAHKJIWKHNG-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)CN1CCC2(C1)CC2
Properties
Complexity:
201
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:
0
Isotope Atom Count:
0
Molecular Weight:
187.286g/mol
Monoisotopic Mass:
187.136g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
3.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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