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Home > Other Heterocycles > 2060048-52-2
2060048-52-2 | 2-{spiro[2.5]octan-6-yl}acetonitrile
CAS No: 2060048-52-2 Catalog No: AG01BZ7W MDL No:MFCD30487897
Product Description
Catalog Number:
AG01BZ7W
Chemical Name:
2-{spiro[2.5]octan-6-yl}acetonitrile
CAS Number:
2060048-52-2
Molecular Formula:
C10H15N
Molecular Weight:
149.2328
MDL Number:
MFCD30487897
IUPAC Name:
2-spiro[2.5]octan-6-ylacetonitrile
InChI:
InChI=1S/C10H15N/c11-8-3-9-1-4-10(5-2-9)6-7-10/h9H,1-7H2
InChI Key:
HLJFRPQUNVCRDN-UHFFFAOYSA-N
SMILES:
N#CCC1CCC2(CC1)CC2
Properties
Complexity:
184
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
149.12g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
149.237g/mol
Monoisotopic Mass:
149.12g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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