2-Propanol, 1-chloro-, phosphate (3:1)


Chemical Name: 2-Propanol, 1-chloro-, phosphate (3:1)
CAS Number: 13674-84-5
Product Number: AG001Y1L(AGN-PC-0O1AZ6)
Synonyms:
MDL No:
Molecular Formula: C9H18Cl3O4P
Molecular Weight: 327.5696

Identification/Properties


Computed Properties
Molecular Weight:
327.563g/mol
XLogP3:
2.6
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
9
Exact Mass:
326.001g/mol
Monoisotopic Mass:
326.001g/mol
Topological Polar Surface Area:
44.8A^2
Heavy Atom Count:
17
Formal Charge:
0
Complexity:
216
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
3
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

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NMR Spectrum


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