200,000+ products from a single source!
sales@angenechem.com
Home > Other Heterocycles > 73813-51-1
73813-51-1 | 6-phenyl-7-oxa-3lambda6-thiabicyclo[4.1.0]heptane-3,3-dione
CAS No: 73813-51-1 Catalog No: AG01BQDD MDL No:MFCD30501305
Product Description
Catalog Number:
AG01BQDD
Chemical Name:
6-phenyl-7-oxa-3lambda6-thiabicyclo[4.1.0]heptane-3,3-dione
CAS Number:
73813-51-1
Molecular Formula:
C11H12O3S
Molecular Weight:
224.2762
MDL Number:
MFCD30501305
IUPAC Name:
6-phenyl-7-oxa-3λ6-thiabicyclo[4.1.0]heptane 3,3-dioxide
InChI:
InChI=1S/C11H12O3S/c12-15(13)7-6-11(10(8-15)14-11)9-4-2-1-3-5-9/h1-5,10H,6-8H2
InChI Key:
JSAHTESEOICBQI-UHFFFAOYSA-N
SMILES:
O=S1(=O)CCC2(C(C1)O2)c1ccccc1
Properties
Complexity:
351
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.051g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
224.274g/mol
Monoisotopic Mass:
224.051g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
55A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.