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Home > Other Heterocycles > 1855621-77-0
1855621-77-0 | 5-ethyl-1-oxaspiro[2.5]octane-2-carbonitrile
CAS No: 1855621-77-0 Catalog No: AG01C6V2 MDL No:MFCD31432454
Product Description
Catalog Number:
AG01C6V2
Chemical Name:
5-ethyl-1-oxaspiro[2.5]octane-2-carbonitrile
CAS Number:
1855621-77-0
Molecular Formula:
C10H15NO
Molecular Weight:
165.2322
MDL Number:
MFCD31432454
IUPAC Name:
5-ethyl-1-oxaspiro[2.5]octane-2-carbonitrile
InChI:
InChI=1S/C10H15NO/c1-2-8-4-3-5-10(6-8)9(7-11)12-10/h8-9H,2-6H2,1H3
InChI Key:
QSFACOGOIUQQEN-UHFFFAOYSA-N
SMILES:
CCC1CCCC2(C1)OC2C#N
Properties
Complexity:
229
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
165.115g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
165.236g/mol
Monoisotopic Mass:
165.115g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
36.3A^2
Undefined Atom Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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