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Home > Other Heterocycles > 1854510-11-4
1854510-11-4 | 4-methyl-1-oxaspiro[2.4]heptane-2-carbonitrile
CAS No: 1854510-11-4 Catalog No: AG01C6TJ MDL No:MFCD31432417
Product Description
Catalog Number:
AG01C6TJ
Chemical Name:
4-methyl-1-oxaspiro[2.4]heptane-2-carbonitrile
CAS Number:
1854510-11-4
Molecular Formula:
C8H11NO
Molecular Weight:
137.1790
MDL Number:
MFCD31432417
IUPAC Name:
4-methyl-1-oxaspiro[2.4]heptane-2-carbonitrile
InChI:
InChI=1S/C8H11NO/c1-6-3-2-4-8(6)7(5-9)10-8/h6-7H,2-4H2,1H3
InChI Key:
FHXVHRDINHJVJZ-UHFFFAOYSA-N
SMILES:
N#CC1OC21CCCC2C
Properties
Complexity:
205
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
137.084g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
137.182g/mol
Monoisotopic Mass:
137.084g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
36.3A^2
Undefined Atom Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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