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Home > Other Heterocycles > 7677-96-5
7677-96-5 | spiro[benzo[d][1,3]dioxole-2,4'-piperidine]
CAS No: 7677-96-5 Catalog No: AG00GFP4 MDL No:MFCD01646389
Product Description
Catalog Number:
AG00GFP4
Chemical Name:
spiro[benzo[d][1,3]dioxole-2,4'-piperidine]
CAS Number:
7677-96-5
Molecular Formula:
C11H13NO2
Molecular Weight:
191.2264
MDL Number:
MFCD01646389
IUPAC Name:
spiro[1,3-benzodioxole-2,4'-piperidine]
InChI:
InChI=1S/C11H13NO2/c1-2-4-10-9(3-1)13-11(14-10)5-7-12-8-6-11/h1-4,12H,5-8H2
InChI Key:
QVKNICXDNWDLFN-UHFFFAOYSA-N
SMILES:
N1CCC2(CC1)Oc1c(O2)cccc1
Properties
Complexity:
197
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.095g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
191.23g/mol
Monoisotopic Mass:
191.095g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
30.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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