[1-di(propan-2-yloxy)phosphorylcyclohexyl]-trimethylsilane

C15H33O3PSi — CID 11823380

IUPAC[1-di(propan-2-yloxy)phosphorylcyclohexyl]-trimethylsilane
SMILESCC(C)OP(=O)(OC(C)C)C1([Si](C)(C)C)CCCCC1
InChIInChI=1S/C15H33O3PSi/c1-13(2)17-19(16,18-14(3)4)15(20(5,6)7)11-9-8-10-12-15/h13-14H,8-12H2,1-7H3
InChIKeyFCJIMLXKFAVNIG-UHFFFAOYSA-N
MW320.49 g/mol
LogP5.61
Rot. Bonds6

About [1-di(propan-2-yloxy)phosphorylcyclohexyl]-trimethylsilane

[1-di(propan-2-yloxy)phosphorylcyclohexyl]-trimethylsilane (PubChem CID 11823380) has the molecular formula C15H33O3PSi and a molecular weight of 320.49 g/mol. Its IUPAC name is [1-di(propan-2-yloxy)phosphorylcyclohexyl]-trimethylsilane.

Molecular Properties

Compound Name[1-di(propan-2-yloxy)phosphorylcyclohexyl]-trimethylsilane
PubChem CID11823380
Molecular FormulaC15H33O3PSi
Molecular Weight320.49 g/mol
Exact Mass320.19
IUPAC Name[1-di(propan-2-yloxy)phosphorylcyclohexyl]-trimethylsilane
SMILESCC(C)OP(=O)(OC(C)C)C1([Si](C)(C)C)CCCCC1
InChIInChI=1S/C15H33O3PSi/c1-13(2)17-19(16,18-14(3)4)15(20(5,6)7)11-9-8-10-12-15/h13-14H,8-12H2,1-7H3
InChIKeyFCJIMLXKFAVNIG-UHFFFAOYSA-N
XLogP5.61
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500320.49
LogP ≤ 55.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

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Related Compounds

1,1-bis[di(propan-2-yloxy)phosphoryl]cycloheptane
CID 15067933
N-[1-di(propan-2-yloxy)phosphorylcyclohexyl]-4-methylaniline
CID 46500543
6-di(propan-2-yloxy)phosphoryl-3,4-dimethyl-6-methylsulfanyl-2,5-dihydrothiopyran
CID 11198545
2-[dimethylphosphoryloxy(methyl)phosphoryl]oxypropane
CID 158432359
copper bis(dipropan-2-yl phosphate)
CID 159825108
1,1-bis(diethoxyphosphoryl)cyclohexane
CID 14689987
[(2S,7R)-2-methyl-7-propan-2-yloxy-3,4,5,6,7,7a-hexahydro-2H-1-benzofuran-3a-yl] propan-2-yl phosphate
CID 59325781
cis-methyl (1S,2R)-2-chloro-2-di(propan-2-yloxy)phosphoryl-1-methylcyclopropane-1-carboxylate
CID 11823126
[(4-methyl-12-propan-2-yl-1-azacyclododec-12-en-4-yl)-phosphanyloxyphosphoryl]oxyphosphane
CID 126760594
2-methyl-2-[methyl(propan-2-yloxy)phosphoryl]oxypropane
CID 171057571
1-methoxy-1-propan-2-yloxycyclohexane
CID 89137021
(1-hydroxycyclooctyl) acetate
CID 91039609

Frequently Asked Questions

What is the IUPAC name of [1-di(propan-2-yloxy)phosphorylcyclohexyl]-trimethylsilane?
The IUPAC name of [1-di(propan-2-yloxy)phosphorylcyclohexyl]-trimethylsilane (CID 11823380) is [1-di(propan-2-yloxy)phosphorylcyclohexyl]-trimethylsilane.
What is the SMILES notation for [1-di(propan-2-yloxy)phosphorylcyclohexyl]-trimethylsilane?
The canonical SMILES for [1-di(propan-2-yloxy)phosphorylcyclohexyl]-trimethylsilane is CC(C)OP(=O)(OC(C)C)C1([Si](C)(C)C)CCCCC1.
What is the InChIKey of [1-di(propan-2-yloxy)phosphorylcyclohexyl]-trimethylsilane?
The InChIKey is FCJIMLXKFAVNIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H33O3PSi/c1-13(2)17-19(16,18-14(3)4)15(20(5,6)7)11-9-8-10-12-15/h13-14H,8-12H2,1-7H3.
What are the key properties of [1-di(propan-2-yloxy)phosphorylcyclohexyl]-trimethylsilane?
[1-di(propan-2-yloxy)phosphorylcyclohexyl]-trimethylsilane has a molecular weight of 320.49 g/mol, XLogP of 5.61, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-di(propan-2-yloxy)phosphorylcyclohexyl]-trimethylsilane is sourced from PubChem (CID 11823380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).