200,000+ products from a single source!
sales@angenechem.com
Home > Other Heterocycles > 89230-02-4
89230-02-4 | Bicyclo[2.2.2]oct-5-ene-2-carbonitrile, 2-(hydroxymethyl)-1-methoxy-
CAS No: 89230-02-4 Catalog No: AG0044GJ MDL No:
Product Description
Catalog Number:
AG0044GJ
Chemical Name:
Bicyclo[2.2.2]oct-5-ene-2-carbonitrile, 2-(hydroxymethyl)-1-methoxy-
CAS Number:
89230-02-4
Molecular Formula:
C11H15NO2
Molecular Weight:
193.2423
IUPAC Name:
2-(hydroxymethyl)-1-methoxybicyclo[2.2.2]oct-5-ene-2-carbonitrile
InChI:
InChI=1S/C11H15NO2/c1-14-11-4-2-9(3-5-11)6-10(11,7-12)8-13/h2,4,9,13H,3,5-6,8H2,1H3
InChI Key:
BOBLWBMTJYPCGB-UHFFFAOYSA-N
SMILES:
COC12CCC(C=C1)CC2(CO)C#N
Properties
Complexity:
317
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
193.11g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
193.246g/mol
Monoisotopic Mass:
193.11g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
53.2A^2
Undefined Atom Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.