(5-methyl-2-propan-2-ylcyclohexyl)oxyphosphinite

C10H20O2P- — CID 101185774

IUPAC(5-methyl-2-propan-2-ylcyclohexyl)oxyphosphinite
SMILESCC1CCC(C(C)C)C(OP[O-])C1
InChIInChI=1S/C10H20O2P/c1-7(2)9-5-4-8(3)6-10(9)12-13-11/h7-10,13H,4-6H2,1-3H3/q-1
InChIKeyNXDOELFPBPLVSH-UHFFFAOYSA-N
MW203.24 g/mol
LogP2.33
Rot. Bonds3

About (5-methyl-2-propan-2-ylcyclohexyl)oxyphosphinite

(5-methyl-2-propan-2-ylcyclohexyl)oxyphosphinite (PubChem CID 101185774) has the molecular formula C10H20O2P- and a molecular weight of 203.24 g/mol. Its IUPAC name is (5-methyl-2-propan-2-ylcyclohexyl)oxyphosphinite.

Molecular Properties

Compound Name(5-methyl-2-propan-2-ylcyclohexyl)oxyphosphinite
PubChem CID101185774
Molecular FormulaC10H20O2P-
Molecular Weight203.24 g/mol
Exact Mass203.12
IUPAC Name(5-methyl-2-propan-2-ylcyclohexyl)oxyphosphinite
SMILESCC1CCC(C(C)C)C(OP[O-])C1
InChIInChI=1S/C10H20O2P/c1-7(2)9-5-4-8(3)6-10(9)12-13-11/h7-10,13H,4-6H2,1-3H3/q-1
InChIKeyNXDOELFPBPLVSH-UHFFFAOYSA-N
XLogP2.33
TPSA32.29 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.24
LogP ≤ 52.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

(1S,2R,4R)-4-methyl-2-[(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl]oxy-1-propan-2-ylcyclohexane
CID 142760387
(1S,2R,4S)-4-methyl-1-propan-2-yl-2-propan-2-yloxycyclohexane
CID 176736545
(1S,2R,4R)-2-(chloromethoxy)-4-methyl-1-propan-2-ylcyclohexane
CID 2724987
dichloro-[(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl]oxyalumane
CID 16695980
4-methyl-1-propan-2-yl-2-propoxycyclohexane
CID 54499043
(1R,2S,4S)-4-methyl-2-[[(1S,2R,5S)-5-methyl-2-propan-2-ylcyclohexyl]oxydisulfanyl]oxy-1-propan-2-ylcyclohexane
CID 70687940
[(1R,2R,5R)-5-methyl-2-propan-2-ylcyclohexyl] carbonochloridate
CID 13308514
(1S,2R,4R)-2-ethoxy-4-methyl-1-propan-2-ylcyclohexane
CID 11086237
trimethyl-[(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl]oxysilane
CID 11138915
methyl-tris[[(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl]oxy]silane
CID 101270451
trans-(2R,4R)-4-methyl-2-[(2-methylpropan-2-yl)oxy]-1-propan-2-ylcyclohexane
CID 137488514
[bis[[(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl]oxy]phosphinothioyldisulfanyl]-bis[[(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl]oxy]-sulfanylidene-λ5-phosphane
CID 11457094

Frequently Asked Questions

What is the IUPAC name of (5-methyl-2-propan-2-ylcyclohexyl)oxyphosphinite?
The IUPAC name of (5-methyl-2-propan-2-ylcyclohexyl)oxyphosphinite (CID 101185774) is (5-methyl-2-propan-2-ylcyclohexyl)oxyphosphinite.
What is the SMILES notation for (5-methyl-2-propan-2-ylcyclohexyl)oxyphosphinite?
The canonical SMILES for (5-methyl-2-propan-2-ylcyclohexyl)oxyphosphinite is CC1CCC(C(C)C)C(OP[O-])C1.
What is the InChIKey of (5-methyl-2-propan-2-ylcyclohexyl)oxyphosphinite?
The InChIKey is NXDOELFPBPLVSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20O2P/c1-7(2)9-5-4-8(3)6-10(9)12-13-11/h7-10,13H,4-6H2,1-3H3/q-1.
What are the key properties of (5-methyl-2-propan-2-ylcyclohexyl)oxyphosphinite?
(5-methyl-2-propan-2-ylcyclohexyl)oxyphosphinite has a molecular weight of 203.24 g/mol, XLogP of 2.33, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5-methyl-2-propan-2-ylcyclohexyl)oxyphosphinite is sourced from PubChem (CID 101185774), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).