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2-hydroxy-5,5-dimethyl-4-phenyl-1,3,2??-dioxaphosphinan-2-one hydrate

2-hydroxy-5,5-dimethyl-4-phenyl-1,3,2??-dioxaphosphinan-2-one hydrate

CAS: 953776-24-4

Formula: C11H17O5P

SMILES: O.CC1(C)COP(O)(=O)OC1C1=CC=CC=C1

IUPAC: 2-hydroxy-5,5-dimethyl-4-phenyl-1,3,2??-dioxaphosphinan-2-one hydrate

InChI: InChI=1/C11H15O4P.H2O/c1-11(2)8-14-16(12,13)15-10(11)9-6-4-3-5-7-9;/h3-7,10H,8H2,1-2H3,(H,12,13);1H2

Composition: C (50.77%), H (6.59%), O (30.74%), P (11.90%)

Molar Mass: 260.226

Atom Count: 34

Heavy Atom Count: 17

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 1
Exact Mass 260.081360645
Formal Charge 0
FSP3 0.45
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey MHOPBMJZQKXMOE-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 59.56
Topological Polar Surface Area 55.76
Polarizability 23.96
Ring Count 2
Rotatable Bond Count 1

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Key Organics Ltd
Purity LeadTime CAS PacketSize UnitPrice
95% <2 Days 953776-24-4 $51.35-$120.18$51.35$63.37$75.38$86.31$120.18
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Key Organics Ltd
Purity LeadTime CAS PacketSize UnitPrice
95% <2 Days 953776-24-4 $51.35-$120.18$51.35$63.37$75.38$86.31$120.18
Request Quote