[2,3-di(propan-2-yloxy)phenyl]phosphane

C12H19O2P — CID 21468187

IUPAC[2,3-di(propan-2-yloxy)phenyl]phosphane
SMILESCC(C)Oc1cccc(P)c1OC(C)C
InChIInChI=1S/C12H19O2P/c1-8(2)13-10-6-5-7-11(15)12(10)14-9(3)4/h5-9H,15H2,1-4H3
InChIKeyJYGVTYXMEQGVOB-UHFFFAOYSA-N
MW226.26 g/mol
LogP2.76
Rot. Bonds4

About [2,3-di(propan-2-yloxy)phenyl]phosphane

[2,3-di(propan-2-yloxy)phenyl]phosphane (PubChem CID 21468187) has the molecular formula C12H19O2P and a molecular weight of 226.26 g/mol. Its IUPAC name is [2,3-di(propan-2-yloxy)phenyl]phosphane.

Molecular Properties

Compound Name[2,3-di(propan-2-yloxy)phenyl]phosphane
PubChem CID21468187
Molecular FormulaC12H19O2P
Molecular Weight226.26 g/mol
Exact Mass226.11
IUPAC Name[2,3-di(propan-2-yloxy)phenyl]phosphane
SMILESCC(C)Oc1cccc(P)c1OC(C)C
InChIInChI=1S/C12H19O2P/c1-8(2)13-10-6-5-7-11(15)12(10)14-9(3)4/h5-9H,15H2,1-4H3
InChIKeyJYGVTYXMEQGVOB-UHFFFAOYSA-N
XLogP2.76
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.26
LogP ≤ 52.76
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

CID 18764013
CID 18764013
[3-phenyl-2,4-di(propan-2-yloxy)phenyl]phosphane
CID 167595135
[2,3-di(propan-2-yloxy)phenyl] acetate
CID 19833391
2-bromo-1,3-di(propan-2-yloxy)benzene
CID 102493711
4-propan-2-yloxy-1-benzofuran
CID 68788950
cyclohexylcyclohexane;[2-[2,6-di(propan-2-yloxy)phenyl]phenyl]phosphane
CID 175023032
1,4,9,10-tetra(propan-2-yloxy)anthracene
CID 139930355
2-(1-amino-2-hydroxyethyl)-3-propan-2-yloxyphenol
CID 84678506
4-propan-2-yloxy-1-benzofuran-2-carboxylic acid
CID 68711544
1,2,9,10-tetra(propan-2-yloxy)anthracene
CID 139929958
1,2-di(propan-2-yloxy)anthracene
CID 174565596
1-bromo-4-propan-2-yloxynaphthalene
CID 15341859

Frequently Asked Questions

What is the IUPAC name of [2,3-di(propan-2-yloxy)phenyl]phosphane?
The IUPAC name of [2,3-di(propan-2-yloxy)phenyl]phosphane (CID 21468187) is [2,3-di(propan-2-yloxy)phenyl]phosphane.
What is the SMILES notation for [2,3-di(propan-2-yloxy)phenyl]phosphane?
The canonical SMILES for [2,3-di(propan-2-yloxy)phenyl]phosphane is CC(C)Oc1cccc(P)c1OC(C)C.
What is the InChIKey of [2,3-di(propan-2-yloxy)phenyl]phosphane?
The InChIKey is JYGVTYXMEQGVOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19O2P/c1-8(2)13-10-6-5-7-11(15)12(10)14-9(3)4/h5-9H,15H2,1-4H3.
What are the key properties of [2,3-di(propan-2-yloxy)phenyl]phosphane?
[2,3-di(propan-2-yloxy)phenyl]phosphane has a molecular weight of 226.26 g/mol, XLogP of 2.76, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2,3-di(propan-2-yloxy)phenyl]phosphane is sourced from PubChem (CID 21468187), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).