200,000+ products from a single source!
sales@angenechem.com
Home > Other Heterocycles > 4704-96-5
4704-96-5 | 2,6,7-Trioxa-1-phosphabicyclo[2.2.2]octane, 1-sulfide
CAS No: 4704-96-5 Catalog No: AG0071MN MDL No:
Product Description
Catalog Number:
AG0071MN
Chemical Name:
2,6,7-Trioxa-1-phosphabicyclo[2.2.2]octane, 1-sulfide
CAS Number:
4704-96-5
Molecular Formula:
C4H7O3PS
Molecular Weight:
166.1353
IUPAC Name:
1-sulfanylidene-2,6,7-trioxa-1λ5-phosphabicyclo[2.2.2]octane
InChI:
InChI=1S/C4H7O3PS/c9-8-5-1-4(2-6-8)3-7-8/h4H,1-3H2
InChI Key:
AFAZSXMGKFJKBJ-UHFFFAOYSA-N
SMILES:
S=P12OCC(CO1)CO2
Properties
Complexity:
143
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
165.985g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
166.131g/mol
Monoisotopic Mass:
165.985g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
59.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
Related Products
© 2019 Angene International Limited. All rights Reserved.