(2-cyclohexyl-3,3-difluoro-1,2,3a,4,5,6,7,7a-octahydroinden-4-yl)phosphane

C15H25F2P — CID 143771443

IUPAC(2-cyclohexyl-3,3-difluoro-1,2,3a,4,5,6,7,7a-octahydroinden-4-yl)phosphane
SMILESFC1(F)C(C2CCCCC2)CC2CCCC(P)C21
InChIInChI=1S/C15H25F2P/c16-15(17)12(10-5-2-1-3-6-10)9-11-7-4-8-13(18)14(11)15/h10-14H,1-9,18H2
InChIKeyOGWZWZJBALFIPH-UHFFFAOYSA-N
MW274.33 g/mol
LogP4.88
Rot. Bonds1

About (2-cyclohexyl-3,3-difluoro-1,2,3a,4,5,6,7,7a-octahydroinden-4-yl)phosphane

(2-cyclohexyl-3,3-difluoro-1,2,3a,4,5,6,7,7a-octahydroinden-4-yl)phosphane (PubChem CID 143771443) has the molecular formula C15H25F2P and a molecular weight of 274.33 g/mol. Its IUPAC name is (2-cyclohexyl-3,3-difluoro-1,2,3a,4,5,6,7,7a-octahydroinden-4-yl)phosphane.

Molecular Properties

Compound Name(2-cyclohexyl-3,3-difluoro-1,2,3a,4,5,6,7,7a-octahydroinden-4-yl)phosphane
PubChem CID143771443
Molecular FormulaC15H25F2P
Molecular Weight274.33 g/mol
Exact Mass274.17
IUPAC Name(2-cyclohexyl-3,3-difluoro-1,2,3a,4,5,6,7,7a-octahydroinden-4-yl)phosphane
SMILESFC1(F)C(C2CCCCC2)CC2CCCC(P)C21
InChIInChI=1S/C15H25F2P/c16-15(17)12(10-5-2-1-3-6-10)9-11-7-4-8-13(18)14(11)15/h10-14H,1-9,18H2
InChIKeyOGWZWZJBALFIPH-UHFFFAOYSA-N
XLogP4.88
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.33
LogP ≤ 54.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

9,9-difluorobicyclo[6.1.0]nonane
CID 12610907
(2R)-2-cyclohexyl-1,1-difluorocyclohexane
CID 125450825
7-cyclobutyl-8-cycloheptyl-7-cyclohexyl-8-cyclopentyl-6-cyclopropyl-1,2,3,4,4a,5,6,8a-octahydronaphthalene
CID 141142279
1,2,3,3a,4,5,6,7,8,9,10,10a-dodecahydrocyclopenta[9]annulene
CID 58552309
1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene;2,3,3a,4,5,6,7,7a-octahydro-1H-indene;1,2,3,3a,4,5,6,6a-octahydropentalene;cyclobutane;cycloheptane;cyclohexane;cyclooctane;cyclopentane;cyclopropane
CID 158726060
(3aR,12aR)-1,2,3,3a,4,5,6,7,8,9,10,11,12,12a-tetradecahydrocyclopenta[11]annulene
CID 14112261
pentacyclo[11.9.0.03,11.05,9.015,21]docosane
CID 132819456
(1R,6S)-2,2-difluorobicyclo[4.1.0]heptane
CID 163491628
3,3,4,5-tetrafluoro-2-(4-propylcyclohexyl)-1,2,3a,4,5,6,7,7a-octahydroindene
CID 70806825
bicyclo[11.1.0]tetradecane
CID 90981498
bicyclo[21.1.0]tetracosane
CID 123789596
1,2,3,3a,4,5,6,6a-octahydropentalene;cyclopentane;ethane
CID 161297906

Frequently Asked Questions

What is the IUPAC name of (2-cyclohexyl-3,3-difluoro-1,2,3a,4,5,6,7,7a-octahydroinden-4-yl)phosphane?
The IUPAC name of (2-cyclohexyl-3,3-difluoro-1,2,3a,4,5,6,7,7a-octahydroinden-4-yl)phosphane (CID 143771443) is (2-cyclohexyl-3,3-difluoro-1,2,3a,4,5,6,7,7a-octahydroinden-4-yl)phosphane.
What is the SMILES notation for (2-cyclohexyl-3,3-difluoro-1,2,3a,4,5,6,7,7a-octahydroinden-4-yl)phosphane?
The canonical SMILES for (2-cyclohexyl-3,3-difluoro-1,2,3a,4,5,6,7,7a-octahydroinden-4-yl)phosphane is FC1(F)C(C2CCCCC2)CC2CCCC(P)C21.
What is the InChIKey of (2-cyclohexyl-3,3-difluoro-1,2,3a,4,5,6,7,7a-octahydroinden-4-yl)phosphane?
The InChIKey is OGWZWZJBALFIPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25F2P/c16-15(17)12(10-5-2-1-3-6-10)9-11-7-4-8-13(18)14(11)15/h10-14H,1-9,18H2.
What are the key properties of (2-cyclohexyl-3,3-difluoro-1,2,3a,4,5,6,7,7a-octahydroinden-4-yl)phosphane?
(2-cyclohexyl-3,3-difluoro-1,2,3a,4,5,6,7,7a-octahydroinden-4-yl)phosphane has a molecular weight of 274.33 g/mol, XLogP of 4.88, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (2-cyclohexyl-3,3-difluoro-1,2,3a,4,5,6,7,7a-octahydroinden-4-yl)phosphane is sourced from PubChem (CID 143771443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).