200,000+ products from a single source!
sales@angenechem.com
Home > Other Heterocycles > 292606-92-9
292606-92-9 | 3-Azabicyclo[4.1.0]hept-4-ene, 3-[(4-methylphenyl)sulfonyl]-
CAS No: 292606-92-9 Catalog No: AG002XVR MDL No:
Product Description
Catalog Number:
AG002XVR
Chemical Name:
3-Azabicyclo[4.1.0]hept-4-ene, 3-[(4-methylphenyl)sulfonyl]-
CAS Number:
292606-92-9
Molecular Formula:
C13H15NO2S
Molecular Weight:
249.3287
IUPAC Name:
3-(4-methylphenyl)sulfonyl-3-azabicyclo[4.1.0]hept-4-ene
InChI:
InChI=1S/C13H15NO2S/c1-10-2-4-13(5-3-10)17(15,16)14-7-6-11-8-12(11)9-14/h2-7,11-12H,8-9H2,1H3
InChI Key:
QTZXUWQWFYSMMJ-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)S(=O)(=O)N1C=CC2C(C1)C2
Properties
Complexity:
415
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
249.082g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
249.328g/mol
Monoisotopic Mass:
249.082g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.