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Home Halogens Di-tert-butyl chloromethyl phosphate

Di-tert-butyl chloromethyl phosphate

CAS No.:
229625-50-7
Catalog Number:
AG002LP9
Molecular Formula:
C9H20ClO4P
Molecular Weight:
258.6795
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
In Stock USA
United States
$63
- +
5g
97%
In Stock USA
United States
$200
- +
25g
97%
In Stock USA
United States
$800
- +
100g
97%
In Stock USA
United States
$2063
- +
Product Description
Catalog Number:
AG002LP9
Chemical Name:
Di-tert-butyl chloromethyl phosphate
CAS Number:
229625-50-7
Molecular Formula:
C9H20ClO4P
Molecular Weight:
258.6795
MDL Number:
MFCD12165895
IUPAC Name:
ditert-butyl chloromethyl phosphate
InChI:
InChI=1S/C9H20ClO4P/c1-8(2,3)13-15(11,12-7-10)14-9(4,5)6/h7H2,1-6H3
InChI Key:
LNJAJHJFSKUCIR-UHFFFAOYSA-N
SMILES:
ClCOP(=O)(OC(C)(C)C)OC(C)(C)C
Properties
Complexity:
222  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
258.079g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
258.679g/mol
Monoisotopic Mass:
258.079g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
44.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Literature
Title Journal
Phosphonooxymethyl prodrugs of the broad spectrum antifungal azole, ravuconazole: synthesis and biological properties. Bioorganic & medicinal chemistry letters 20031103
Properties