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Home > Other Heterocycles > 2060033-47-6
2060033-47-6 | 1-methyl-2-{7-oxaspiro[bicyclo[4.1.0]heptane-3,1'-cyclopropane]-6-yl}-1H-pyrrole
CAS No: 2060033-47-6 Catalog No: AG01BQD0 MDL No:MFCD30501292
Product Description
Catalog Number:
AG01BQD0
Chemical Name:
1-methyl-2-{7-oxaspiro[bicyclo[4.1.0]heptane-3,1'-cyclopropane]-6-yl}-1H-pyrrole
CAS Number:
2060033-47-6
Molecular Formula:
C13H17NO
Molecular Weight:
203.2802
MDL Number:
MFCD30501292
IUPAC Name:
1-methyl-2-spiro[7-oxabicyclo[4.1.0]heptane-4,1'-cyclopropane]-1-ylpyrrole
InChI:
InChI=1S/C13H17NO/c1-14-8-2-3-10(14)13-7-6-12(4-5-12)9-11(13)15-13/h2-3,8,11H,4-7,9H2,1H3
InChI Key:
MLYMZECTXHCHSM-UHFFFAOYSA-N
SMILES:
Cn1cccc1C12CCC3(CC2O1)CC3
Properties
Complexity:
299
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
203.131g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
203.285g/mol
Monoisotopic Mass:
203.131g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
17.5A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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