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Home > Other Heterocycles > 36929-35-8
36929-35-8 | 1-Oxaspiro[2.4]heptane-2-carbonitrile
CAS No: 36929-35-8 Catalog No: AG0077MM MDL No:MFCD00101215
Product Description
Catalog Number:
AG0077MM
Chemical Name:
1-Oxaspiro[2.4]heptane-2-carbonitrile
CAS Number:
36929-35-8
Molecular Formula:
C7H9NO
Molecular Weight:
123.1525
MDL Number:
MFCD00101215
IUPAC Name:
1-oxaspiro[2.4]heptane-2-carbonitrile
InChI:
InChI=1S/C7H9NO/c8-5-6-7(9-6)3-1-2-4-7/h6H,1-4H2
InChI Key:
GFCYZQVCDGGQOP-UHFFFAOYSA-N
SMILES:
N#CC1OC21CCCC2
Properties
Complexity:
173
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
123.068g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
123.155g/mol
Monoisotopic Mass:
123.068g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
36.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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