3,3-bis(2-methoxyphenyl)propylphosphane

C17H21O2P — CID 57073175

IUPAC3,3-bis(2-methoxyphenyl)propylphosphane
SMILESCOc1ccccc1C(CCP)c1ccccc1OC
InChIInChI=1S/C17H21O2P/c1-18-16-9-5-3-7-14(16)13(11-12-20)15-8-4-6-10-17(15)19-2/h3-10,13H,11-12,20H2,1-2H3
InChIKeyANOMBDMSCDSVBR-UHFFFAOYSA-N
MW288.33 g/mol
LogP4.10
Rot. Bonds6

About 3,3-bis(2-methoxyphenyl)propylphosphane

3,3-bis(2-methoxyphenyl)propylphosphane (PubChem CID 57073175) has the molecular formula C17H21O2P and a molecular weight of 288.33 g/mol. Its IUPAC name is 3,3-bis(2-methoxyphenyl)propylphosphane.

Molecular Properties

Compound Name3,3-bis(2-methoxyphenyl)propylphosphane
PubChem CID57073175
Molecular FormulaC17H21O2P
Molecular Weight288.33 g/mol
Exact Mass288.13
IUPAC Name3,3-bis(2-methoxyphenyl)propylphosphane
SMILESCOc1ccccc1C(CCP)c1ccccc1OC
InChIInChI=1S/C17H21O2P/c1-18-16-9-5-3-7-14(16)13(11-12-20)15-8-4-6-10-17(15)19-2/h3-10,13H,11-12,20H2,1-2H3
InChIKeyANOMBDMSCDSVBR-UHFFFAOYSA-N
XLogP4.10
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.33
LogP ≤ 54.10
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

3,3-bis(2-methoxyphenyl)propyl-methyl-di(propan-2-yl)azanium
CID 10163796
[(1S)-1-(2-methoxyphenyl)ethyl]phosphane
CID 130462203
3-(2-methoxyphenyl)pentane-1,5-diol
CID 51050570
(1S)-1-(2-methoxyphenyl)propane-1,3-diamine
CID 171219974
1-bromo-4-[1-(2-methoxyphenyl)butyl]benzene
CID 58302960
ethane;1-methoxy-2-propan-2-ylbenzene
CID 144548142
ethane;1-methoxy-2-propan-2-ylbenzene
CID 142030907
1-(1-bromo-2-phenylethyl)-2-methoxybenzene
CID 63017425
(3S)-3-(furan-2-yl)-3-(2-methoxyphenyl)propan-1-amine
CID 729616
2-methoxy-1-(2-methoxyphenyl)pentan-1-amine
CID 116718510
N-benzyl-1-phenylmethanamine;1-methoxy-2-[1-(2-methoxyphenyl)propyl]benzene
CID 70442931
1-methoxy-2-(2,2,4,4-tetramethylpentan-3-yl)benzene
CID 173474378

Frequently Asked Questions

What is the IUPAC name of 3,3-bis(2-methoxyphenyl)propylphosphane?
The IUPAC name of 3,3-bis(2-methoxyphenyl)propylphosphane (CID 57073175) is 3,3-bis(2-methoxyphenyl)propylphosphane.
What is the SMILES notation for 3,3-bis(2-methoxyphenyl)propylphosphane?
The canonical SMILES for 3,3-bis(2-methoxyphenyl)propylphosphane is COc1ccccc1C(CCP)c1ccccc1OC.
What is the InChIKey of 3,3-bis(2-methoxyphenyl)propylphosphane?
The InChIKey is ANOMBDMSCDSVBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21O2P/c1-18-16-9-5-3-7-14(16)13(11-12-20)15-8-4-6-10-17(15)19-2/h3-10,13H,11-12,20H2,1-2H3.
What are the key properties of 3,3-bis(2-methoxyphenyl)propylphosphane?
3,3-bis(2-methoxyphenyl)propylphosphane has a molecular weight of 288.33 g/mol, XLogP of 4.10, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3-bis(2-methoxyphenyl)propylphosphane is sourced from PubChem (CID 57073175), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).