200,000+ products from a single source!
sales@angenechem.com
651314-04-4 | 1-Azabicyclo[4.2.0]octane, 6-[(1Z)-2-(5-isoxazolyl)ethenyl]-
CAS No: 651314-04-4 Catalog No: AG006R2V MDL No:
Product Description
Catalog Number:
AG006R2V
Chemical Name:
1-Azabicyclo[4.2.0]octane, 6-[(1Z)-2-(5-isoxazolyl)ethenyl]-
CAS Number:
651314-04-4
Molecular Formula:
C12H16N2O
Molecular Weight:
204.2682
IUPAC Name:
5-[2-(1-azabicyclo[4.2.0]octan-6-yl)ethenyl]-1,2-oxazole
InChI:
InChI=1S/C12H16N2O/c1-2-9-14-10-7-12(14,5-1)6-3-11-4-8-13-15-11/h3-4,6,8H,1-2,5,7,9-10H2
InChI Key:
WKQYZRHSOAYPCB-UHFFFAOYSA-N
SMILES:
c1noc(c1)/C=C\C12CCCCN2CC1
Properties
Complexity:
266
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.126g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
204.273g/mol
Monoisotopic Mass:
204.126g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
29.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
1
XLogP3:
1.7
Related Products
© 2019 Angene International Limited. All rights Reserved.