[(1R,2S,4R)-2-bicyclo[2.2.1]heptanyl]-diphenylphosphane

C19H21P — CID 102055643

IUPAC[(1R,2S,4R)-2-bicyclo[2.2.1]heptanyl]-diphenylphosphane
SMILESc1ccc(P(c2ccccc2)[C@H]2C[C@@H]3CC[C@@H]2C3)cc1
InChIInChI=1S/C19H21P/c1-3-7-17(8-4-1)20(18-9-5-2-6-10-18)19-14-15-11-12-16(19)13-15/h1-10,15-16,19H,11-14H2/t15-,16-,19+/m1/s1
InChIKeyOLZZPWBKRIFEJN-MDZRGWNJSA-N
MW280.35 g/mol
LogP4.31
Rot. Bonds3

About [(1R,2S,4R)-2-bicyclo[2.2.1]heptanyl]-diphenylphosphane

[(1R,2S,4R)-2-bicyclo[2.2.1]heptanyl]-diphenylphosphane (PubChem CID 102055643) has the molecular formula C19H21P and a molecular weight of 280.35 g/mol. Its IUPAC name is [(1R,2S,4R)-2-bicyclo[2.2.1]heptanyl]-diphenylphosphane.

Molecular Properties

Compound Name[(1R,2S,4R)-2-bicyclo[2.2.1]heptanyl]-diphenylphosphane
PubChem CID102055643
Molecular FormulaC19H21P
Molecular Weight280.35 g/mol
Exact Mass280.14
IUPAC Name[(1R,2S,4R)-2-bicyclo[2.2.1]heptanyl]-diphenylphosphane
SMILESc1ccc(P(c2ccccc2)[C@H]2C[C@@H]3CC[C@@H]2C3)cc1
InChIInChI=1S/C19H21P/c1-3-7-17(8-4-1)20(18-9-5-2-6-10-18)19-14-15-11-12-16(19)13-15/h1-10,15-16,19H,11-14H2/t15-,16-,19+/m1/s1
InChIKeyOLZZPWBKRIFEJN-MDZRGWNJSA-N
XLogP4.31
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.35
LogP ≤ 54.31
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

[(1R,2R)-2-diphenylphosphanylcyclohexyl]-diphenylphosphane
CID 59800266
(1S,2R,4R)-2-[(E)-3-phenylprop-2-enyl]bicyclo[2.2.1]heptane
CID 71507650
diphenyl(4-tricyclo[5.2.1.02,6]decanyl)phosphane
CID 117070680
2-diphenylphosphanylcyclohexane-1-thiol
CID 132606226
(1S,4R)-2-phenylbicyclo[2.2.1]heptane
CID 10965003
[(1S,2R,4R)-2-bicyclo[2.2.1]heptanyl]-[(1S,2S,4R)-2-bicyclo[2.2.1]heptanyl]-[(1R)-1-[2-(2-diphenylphosphanylphenyl)cyclopentyl]ethyl]phosphane
CID 98462259
2-diphenylphosphanylcyclohexan-1-ol
CID 15198683
(1R)-2-diphenylphosphanylcyclohexan-1-amine
CID 155884941
[(1S,2R,4S)-2-bicyclo[2.2.1]hept-5-enyl]-diphenylphosphane
CID 129111578
2-[3-(2-diphenylphosphanylpropan-2-yl)-2-bicyclo[2.2.1]heptanyl]propan-2-yl-diphenylphosphane
CID 23403234
[(1R,2R,3S,4S)-3-(diphenylphosphanylmethyl)-2-bicyclo[2.2.1]heptanyl]methyl-diphenylphosphane
CID 13296398
cyclononyl(diphenyl)phosphane
CID 70908257

Frequently Asked Questions

What is the IUPAC name of [(1R,2S,4R)-2-bicyclo[2.2.1]heptanyl]-diphenylphosphane?
The IUPAC name of [(1R,2S,4R)-2-bicyclo[2.2.1]heptanyl]-diphenylphosphane (CID 102055643) is [(1R,2S,4R)-2-bicyclo[2.2.1]heptanyl]-diphenylphosphane.
What is the SMILES notation for [(1R,2S,4R)-2-bicyclo[2.2.1]heptanyl]-diphenylphosphane?
The canonical SMILES for [(1R,2S,4R)-2-bicyclo[2.2.1]heptanyl]-diphenylphosphane is c1ccc(P(c2ccccc2)[C@H]2C[C@@H]3CC[C@@H]2C3)cc1.
What is the InChIKey of [(1R,2S,4R)-2-bicyclo[2.2.1]heptanyl]-diphenylphosphane?
The InChIKey is OLZZPWBKRIFEJN-MDZRGWNJSA-N. The full InChI is InChI=1S/C19H21P/c1-3-7-17(8-4-1)20(18-9-5-2-6-10-18)19-14-15-11-12-16(19)13-15/h1-10,15-16,19H,11-14H2/t15-,16-,19+/m1/s1.
What are the key properties of [(1R,2S,4R)-2-bicyclo[2.2.1]heptanyl]-diphenylphosphane?
[(1R,2S,4R)-2-bicyclo[2.2.1]heptanyl]-diphenylphosphane has a molecular weight of 280.35 g/mol, XLogP of 4.31, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [(1R,2S,4R)-2-bicyclo[2.2.1]heptanyl]-diphenylphosphane is sourced from PubChem (CID 102055643), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).