200,000+ products from a single source!
sales@angenechem.com
Home > Other Heterocycles > 5301-78-0
5301-78-0 | 2,6,7-Trioxa-1-phosphabicyclo[2.2.2]octane-4-methanol 1-oxide
CAS No: 5301-78-0 Catalog No: AG00342D MDL No:MFCD01677612
Product Description
Catalog Number:
AG00342D
Chemical Name:
2,6,7-Trioxa-1-phosphabicyclo[2.2.2]octane-4-methanol 1-oxide
CAS Number:
5301-78-0
Molecular Formula:
C5H9O5P
Molecular Weight:
180.0957
MDL Number:
MFCD01677612
IUPAC Name:
(1-oxo-2,6,7-trioxa-1λ5-phosphabicyclo[2.2.2]octan-4-yl)methanol
InChI:
InChI=1S/C5H9O5P/c6-1-5-2-8-11(7,9-3-5)10-4-5/h6H,1-4H2
InChI Key:
YASRHLDAFCMIPB-UHFFFAOYSA-N
SMILES:
OCC12COP(=O)(OC1)OC2
Properties
Complexity:
184
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
180.019g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
180.096g/mol
Monoisotopic Mass:
180.019g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
65A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.5
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.