2-(cyclohexyloxy)-6...

2-(cyclohexyloxy)-6-methyl-2,3-dihydro-1,3,2-diazaphosphinin-4(1H)-one 2-oxide(CAS No. 54559-69-2)

2-(cyclohexyloxy)-6-methyl-2,3-dihydro-1,3,2-diazaphosphinin-4(1H)-one 2-oxide(CAS No. 54559-69-2)

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Keywords

2-cyclohexyloxy-4-methyl-2-oxo-1,3-diaza-2$l^C<sub>10</sub>H<sub>17</sub>N<sub>2</sub>O<sub>3</sub>P 54559-69-2 98%

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  • Appearance:Solid
  • Application:Organic Chemicals
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  • ProductionCapacity:1|Metric Ton|Month
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Details:

【Name】
2-(cyclohexyloxy)-6-methyl-2,3-dihydro-1,3,2-diazaphosphinin-4(1H)-one 2-oxide
【Iupac name】
2-cyclohexyloxy-6-methyl-2-oxo-1,3-dihydro-1,3,
2λ5-diazaphosphinin-4-one
【CAS Registry number】
54559-69-2
【Synonyms】
NSC213279
AC1L7GEJ
NSC-213279
2-cyclohexyloxy-6-methyl-2-oxo-1,3-dihydro-1,3,2
1,2-Diazaphosphorin-4(1H)-one, 2-(cyclohexyloxy)-2,3-dihydro-6-methyl, 2-oxide
54559-69-2
【Molecular Formula】
C10H17N2O3P (Products with the same molecular formula)
【Molecular Weight】
244.2273
【Inchi】
InChI=1/C10H17N2O3P/c1-8-7-10(13)12-16(14,11-8)15-9-5-3-2-4-6-9/h7,9H,2-6H2,1H3,(H2,11,12,13,14)
【Canonical SMILES】
CC1=CC(=O)NP(=O)(N1)OC2CCCCC2
Chemical and Physical Properties
【Density】
1.25g/cm3
【Boiling Point】
°Cat760mmHg
【Refractive Index】
1.525
【Flash Point】
°C
【Computed Properties】
Molecular Weight:244.227341 [g/mol]
Molecular Formula:C10H17N2O3P
XLogP3-AA:1.3
H-Bond Donor:2
H-Bond Acceptor:4
Rotatable Bond Count:2
Tautomer Count:9
Exact Mass:244.097679
MonoIsotopic Mass:244.097679
Topological Polar Surface Area:67.4
Heavy Atom Count:16
Formal Charge:0
Complexity:361
Isotope Atom Count:0
Defined Atom Stereocenter Count:0
Undefined Atom Stereocenter Count:1
Defined Bond Stereocenter Count:0
Undefined Bond Stereocenter Count:0
Covalently-Bonded Unit Count:1
Feature 3D Acceptor Count:1
Feature 3D Donor Count:1
Feature 3D Ring Count:2
Effective Rotor Count:3.6
Conformer Sampling RMSD:0.6
CID Conformer Count:13

 

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