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Home > Other Heterocycles > 1849210-91-8
1849210-91-8 | 5-methoxy-1-oxaspiro[2.3]hexane-2-carbonitrile
CAS No: 1849210-91-8 Catalog No: AG01C6WC MDL No:MFCD31432471
Product Description
Catalog Number:
AG01C6WC
Chemical Name:
5-methoxy-1-oxaspiro[2.3]hexane-2-carbonitrile
CAS Number:
1849210-91-8
Molecular Formula:
C7H9NO2
Molecular Weight:
139.1519
MDL Number:
MFCD31432471
IUPAC Name:
5-methoxy-1-oxaspiro[2.3]hexane-2-carbonitrile
InChI:
InChI=1S/C7H9NO2/c1-9-5-2-7(3-5)6(4-8)10-7/h5-6H,2-3H2,1H3
InChI Key:
UZOTZGUEERONFU-UHFFFAOYSA-N
SMILES:
COC1CC2(C1)OC2C#N
Properties
Complexity:
199
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
139.063g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
139.154g/mol
Monoisotopic Mass:
139.063g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
45.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0
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