[(1R,2S)-2-phenylcyclohexyl]oxyphosphinite

C12H16O2P- — CID 102484366

IUPAC[(1R,2S)-2-phenylcyclohexyl]oxyphosphinite
SMILES[O-]PO[C@@H]1CCCC[C@H]1c1ccccc1
InChIInChI=1S/C12H16O2P/c13-15-14-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-3,6-7,11-12,15H,4-5,8-9H2/q-1/t11-,12+/m0/s1
InChIKeyDJRLABNWRVVERY-NWDGAFQWSA-N
MW223.23 g/mol
LogP2.60
Rot. Bonds3

About [(1R,2S)-2-phenylcyclohexyl]oxyphosphinite

[(1R,2S)-2-phenylcyclohexyl]oxyphosphinite (PubChem CID 102484366) has the molecular formula C12H16O2P- and a molecular weight of 223.23 g/mol. Its IUPAC name is [(1R,2S)-2-phenylcyclohexyl]oxyphosphinite.

Molecular Properties

Compound Name[(1R,2S)-2-phenylcyclohexyl]oxyphosphinite
PubChem CID102484366
Molecular FormulaC12H16O2P-
Molecular Weight223.23 g/mol
Exact Mass223.09
IUPAC Name[(1R,2S)-2-phenylcyclohexyl]oxyphosphinite
SMILES[O-]PO[C@@H]1CCCC[C@H]1c1ccccc1
InChIInChI=1S/C12H16O2P/c13-15-14-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-3,6-7,11-12,15H,4-5,8-9H2/q-1/t11-,12+/m0/s1
InChIKeyDJRLABNWRVVERY-NWDGAFQWSA-N
XLogP2.60
TPSA32.29 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.23
LogP ≤ 52.60
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

[(1R,2R)-2-phenylcyclohexyl] [(1S,2R)-2-phenylcyclohexyl] [(1S,2S)-2-phenylcyclohexyl] borate
CID 125124690
[(1R,2S)-2-phenylcyclohexyl] carbonochloridate
CID 15691294
(2-phenylcyclohexyl) formate
CID 87286934
[(1S)-2-phenylcyclohexyl] acetate
CID 130428408
[(1S,2R)-2-prop-2-enoxycyclohexyl]benzene
CID 11264404
[(1R,2S)-2-phenylcyclohexyl] N-[[(1R,2S)-2-phenylcyclohexyl]oxycarbonylamino]carbamate
CID 134883244
trans-(1S,2R)-2-phenylcyclohexan-1-amine;hydrochloride
CID 21128019
(2-phenylcyclohexyl) 2-oxoacetate
CID 13498606
[(1R,2S)-2-buta-1,3-dien-2-yloxycyclohexyl]benzene
CID 102426491
[(1R,2S)-2-phenylcyclopentyl] methanesulfonate
CID 121416459
[(2S)-2-phenylcyclohexyl] 3-phenylprop-2-ynoate
CID 2755291
(2-phenylcyclohexyl) 3-phenylprop-2-ynoate
CID 15189887

Frequently Asked Questions

What is the IUPAC name of [(1R,2S)-2-phenylcyclohexyl]oxyphosphinite?
The IUPAC name of [(1R,2S)-2-phenylcyclohexyl]oxyphosphinite (CID 102484366) is [(1R,2S)-2-phenylcyclohexyl]oxyphosphinite.
What is the SMILES notation for [(1R,2S)-2-phenylcyclohexyl]oxyphosphinite?
The canonical SMILES for [(1R,2S)-2-phenylcyclohexyl]oxyphosphinite is [O-]PO[C@@H]1CCCC[C@H]1c1ccccc1.
What is the InChIKey of [(1R,2S)-2-phenylcyclohexyl]oxyphosphinite?
The InChIKey is DJRLABNWRVVERY-NWDGAFQWSA-N. The full InChI is InChI=1S/C12H16O2P/c13-15-14-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-3,6-7,11-12,15H,4-5,8-9H2/q-1/t11-,12+/m0/s1.
What are the key properties of [(1R,2S)-2-phenylcyclohexyl]oxyphosphinite?
[(1R,2S)-2-phenylcyclohexyl]oxyphosphinite has a molecular weight of 223.23 g/mol, XLogP of 2.60, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(1R,2S)-2-phenylcyclohexyl]oxyphosphinite is sourced from PubChem (CID 102484366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).