Molfinder
Home
Support
About Us
Data Source
Statistics
Blogs
Molecule
ID:74923
Structure
Similarity
Functional Group
Text
General Information
Structure
Molecular Formula
C₁₁H₂₃O₅P
Molecular Mass
266.271081
Exact Mass
266.12831047
Charge
0
InChI
InChI=1S/C11H23O5P/c1-4-14-11(12)9-7-8-10-17(13,15-5-2)16-6-3/h4-10H2,1-3H3
InChIKey
BUDJSZHTNJUBIM-UHFFFAOYSA-N
Canonic Smiles
CCOC(=O)CCCCP(=O)(OCC)OCC
Isomeric Smiles
P(=O)(OCC)(OCC)CCCCC(=O)OCC
Calculated Properties
JChem
H Acceptors
2
H Donor
0
LogD (pH = 5.5)
1.4590185
LogD (pH = 7.4)
1.4590185
Log P
1.4590185
Molar Refractivity
65.4213
Polarizability
26.508768
Polar Surface Area
61.83
Rotatable Bonds
11
Lipinski's Rule of Five
true
Data Source
Loading...
Names and Identifiers
Loading...
Registration numbers
Loading...
Properties
Loading...
Related Proteins
No Data Available
Click here to submit data
Molecular Spectra
No Data Available
Click here to submit data
Molecule Details
暂无数据
点击上传数据
References
Loading...
Bioactivity
Loading...
Quote
Download
Navigation
General Information
Calculated Properties
•
RDKit
•
JChem
Data Source
•
Commercial Catalog
•
Academic Data
Names and Identifiers
•
IUPAC name
•
Synonyms
•
IUPAC Traditional name
Registration numbers
•
CAS Number
•
MDL Number
•
PubChem SID
•
PubChem CID
Properties
•
Safety Information
Related Proteins
Molecular Spectra
Molecule Details
References
•
PubChem Literature
•
From Data Sources
Bioactivity
•
PubChem BioAssay
Data Source
Commercial Catalog
Apollo Scientific
OR10708
Academic Data
PubChem
2773707
Names and Identifiers
IUPAC name
ethyl 5-(diethoxyphosphoryl)pentanoate
Synonyms
Diethyl [4-(ethoxycarbonyl)but-1-yl]phosphonate
Ethyl 5-(diethoxyphosphoryl)pentanoate
IUPAC Traditional name
ethyl 5-(diethoxyphosphoryl)pentanoate
Registration numbers
CAS Number
2323-74-2
MDL Number
MFCD01631209
PubChem SID
162039841
PubChem CID
2773707
Properties
Safety Information
Storage Warning
Irritant
Source
References
PubChem Literature
No Data Available
Click here to submit data
Bioactivity
PubChem BioAssay