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Home > Other Heterocycles > 1363382-01-7
1363382-01-7 | 1-phenyl-1,6-diazaspiro[3.4]octane
CAS No: 1363382-01-7 Catalog No: AG00HUKJ MDL No:
Product Description
Catalog Number:
AG00HUKJ
Chemical Name:
1-phenyl-1,6-diazaspiro[3.4]octane
CAS Number:
1363382-01-7
Molecular Formula:
C12H16N2
Molecular Weight:
188.2688
IUPAC Name:
1-phenyl-1,7-diazaspiro[3.4]octane
InChI:
InChI=1S/C12H16N2/c1-2-4-11(5-3-1)14-9-7-12(14)6-8-13-10-12/h1-5,13H,6-10H2
InChI Key:
XOLOTIMGFFYJOK-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)N1CCC21CNCC2
Properties
Complexity:
210
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.131g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
188.274g/mol
Monoisotopic Mass:
188.131g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
15.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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