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Home > Other Heterocycles > 1803580-67-7
1803580-67-7 | 1-phenyl-2-azaspiro[3.3]heptane
CAS No: 1803580-67-7 Catalog No: AG01BB59 MDL No:MFCD28968159
Product Description
Catalog Number:
AG01BB59
Chemical Name:
1-phenyl-2-azaspiro[3.3]heptane
CAS Number:
1803580-67-7
Molecular Formula:
C12H15N
Molecular Weight:
173.2542
MDL Number:
MFCD28968159
IUPAC Name:
3-phenyl-2-azaspiro[3.3]heptane
InChI:
InChI=1S/C12H15N/c1-2-5-10(6-3-1)11-12(9-13-11)7-4-8-12/h1-3,5-6,11,13H,4,7-9H2
InChI Key:
WBXZRRVBGSPLKV-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)C1NCC21CCC2
Properties
Complexity:
189
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
173.12g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
173.259g/mol
Monoisotopic Mass:
173.12g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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