benzyl(diethoxy)phosphane

C11H17O2P — CID 13274714

IUPACbenzyl(diethoxy)phosphane
SMILESCCOP(Cc1ccccc1)OCC
InChIInChI=1S/C11H17O2P/c1-3-12-14(13-4-2)10-11-8-6-5-7-9-11/h5-9H,3-4,10H2,1-2H3
InChIKeyYOJPYCBLLSSTBL-UHFFFAOYSA-N
MW212.23 g/mol
LogP3.57
Rot. Bonds6

About benzyl(diethoxy)phosphane

benzyl(diethoxy)phosphane (PubChem CID 13274714) has the molecular formula C11H17O2P and a molecular weight of 212.23 g/mol. Its IUPAC name is benzyl(diethoxy)phosphane.

Molecular Properties

Compound Namebenzyl(diethoxy)phosphane
PubChem CID13274714
Molecular FormulaC11H17O2P
Molecular Weight212.23 g/mol
Exact Mass212.10
IUPAC Namebenzyl(diethoxy)phosphane
SMILESCCOP(Cc1ccccc1)OCC
InChIInChI=1S/C11H17O2P/c1-3-12-14(13-4-2)10-11-8-6-5-7-9-11/h5-9H,3-4,10H2,1-2H3
InChIKeyYOJPYCBLLSSTBL-UHFFFAOYSA-N
XLogP3.57
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.23
LogP ≤ 53.57
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

[4-[4-(diethoxyphosphanylmethyl)phenyl]phenyl]methyl-diethoxyphosphane
CID 122230749
benzyl-bis(2-phenylethoxy)phosphane
CID 141159288
(3,5-dimethoxyphenyl)methyl-diethoxyphosphane
CID 71222353
[benzyl-(tetrabutyl-λ5-phosphanyl)oxyphosphanyl]oxy-tetrabutyl-λ5-phosphane
CID 139962612
palladium;bis(tribenzylphosphane)
CID 87652258
benzyl-methyl-propylphosphane
CID 13024967
ethylbenzene;methoxyethane
CID 90842646
(213C)ethoxymethylbenzene
CID 87947851
benzylbenzene;ethoxyethane
CID 69148831
diethoxy-[(1-tritylimidazol-4-yl)methyl]phosphane;ethane
CID 143697389
ethylcyclodecapentaene
CID 90861705
phenyl 2-diethoxyphosphanylethanesulfonate
CID 90443588

Frequently Asked Questions

What is the IUPAC name of benzyl(diethoxy)phosphane?
The IUPAC name of benzyl(diethoxy)phosphane (CID 13274714) is benzyl(diethoxy)phosphane.
What is the SMILES notation for benzyl(diethoxy)phosphane?
The canonical SMILES for benzyl(diethoxy)phosphane is CCOP(Cc1ccccc1)OCC.
What is the InChIKey of benzyl(diethoxy)phosphane?
The InChIKey is YOJPYCBLLSSTBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17O2P/c1-3-12-14(13-4-2)10-11-8-6-5-7-9-11/h5-9H,3-4,10H2,1-2H3.
What are the key properties of benzyl(diethoxy)phosphane?
benzyl(diethoxy)phosphane has a molecular weight of 212.23 g/mol, XLogP of 3.57, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for benzyl(diethoxy)phosphane is sourced from PubChem (CID 13274714), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).