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Home > Other Heterocycles > 2060033-98-7
2060033-98-7 | 1-(1-ethyl-1H-pyrrol-3-yl)-6-oxa-2-azaspiro[3.4]octane
CAS No: 2060033-98-7 Catalog No: AG01BQG7 MDL No:MFCD30501410
Product Description
Catalog Number:
AG01BQG7
Chemical Name:
1-(1-ethyl-1H-pyrrol-3-yl)-6-oxa-2-azaspiro[3.4]octane
CAS Number:
2060033-98-7
Molecular Formula:
C12H18N2O
Molecular Weight:
206.2841
MDL Number:
MFCD30501410
IUPAC Name:
3-(1-ethylpyrrol-3-yl)-6-oxa-2-azaspiro[3.4]octane
InChI:
InChI=1S/C12H18N2O/c1-2-14-5-3-10(7-14)11-12(8-13-11)4-6-15-9-12/h3,5,7,11,13H,2,4,6,8-9H2,1H3
InChI Key:
APDZJIFOWVEWCR-UHFFFAOYSA-N
SMILES:
CCn1ccc(c1)C1NCC21COCC2
Properties
Complexity:
246
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.142g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
206.289g/mol
Monoisotopic Mass:
206.142g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
26.2A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2
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