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85359-52-0 | 1,3,5-Dioxaphosphorinane, 5-chloro-2,4,6-tris(1-methylethyl)-, 5-oxide
CAS No: 85359-52-0 Catalog No: AG004U28 MDL No:
Product Description
Catalog Number:
AG004U28
Chemical Name:
1,3,5-Dioxaphosphorinane, 5-chloro-2,4,6-tris(1-methylethyl)-, 5-oxide
CAS Number:
85359-52-0
Molecular Formula:
C12H24ClO3P
Molecular Weight:
282.7439
IUPAC Name:
5-chloro-2,4,6-tri(propan-2-yl)-1,3,5λ5-dioxaphosphinane 5-oxide
InChI:
InChI=1S/C12H24ClO3P/c1-7(2)10-15-11(8(3)4)17(13,14)12(16-10)9(5)6/h7-12H,1-6H3
InChI Key:
WVIJICIDXIGOFM-UHFFFAOYSA-N
SMILES:
CC(C1OC(C(C)C)P(=O)(C(O1)C(C)C)Cl)C
Properties
Complexity:
282
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
282.115g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
282.745g/mol
Monoisotopic Mass:
282.115g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
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