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Home > Other Heterocycles > 1935978-98-5
1935978-98-5 | hexahydro-1H-spiro[cyclopenta[b]pyrrole-3,4'-oxane]
CAS No: 1935978-98-5 Catalog No: AG01AP6V MDL No:MFCD29034433
Product Description
Catalog Number:
AG01AP6V
Chemical Name:
hexahydro-1H-spiro[cyclopenta[b]pyrrole-3,4'-oxane]
CAS Number:
1935978-98-5
Molecular Formula:
C11H19NO
Molecular Weight:
181.2747
MDL Number:
MFCD29034433
IUPAC Name:
spiro[2,3a,4,5,6,6a-hexahydro-1H-cyclopenta[b]pyrrole-3,4'-oxane]
InChI:
InChI=1S/C11H19NO/c1-2-9-10(3-1)12-8-11(9)4-6-13-7-5-11/h9-10,12H,1-8H2
InChI Key:
NXWWNEIARFFJNF-UHFFFAOYSA-N
SMILES:
O1CCC2(CC1)CNC1C2CCC1
Properties
Complexity:
198
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
181.147g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
181.279g/mol
Monoisotopic Mass:
181.147g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
21.3A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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