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Home > Other Heterocycles > 1416438-72-6
1416438-72-6 | 2-Azaspiro[3.3]heptane, 2-(phenylmethyl)-
CAS No: 1416438-72-6 Catalog No: AG001GSH MDL No:
Product Description
Catalog Number:
AG001GSH
Chemical Name:
2-Azaspiro[3.3]heptane, 2-(phenylmethyl)-
CAS Number:
1416438-72-6
Molecular Formula:
C13H17N
Molecular Weight:
187.2808
IUPAC Name:
2-benzyl-2-azaspiro[3.3]heptane
InChI:
InChI=1S/C13H17N/c1-2-5-12(6-3-1)9-14-10-13(11-14)7-4-8-13/h1-3,5-6H,4,7-11H2
InChI Key:
WCIHJDHZGRPNOX-UHFFFAOYSA-N
SMILES:
C1CC2(C1)CN(C2)Cc1ccccc1
Properties
Complexity:
193
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:
2.7
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