Molfinder
主页
技术支持
关于我们
数据来源
数据统计
博客
Molecule
ID:11898
Structure
Similarity
Functional Group
Text
General Information
Structure
Molecular Formula
C₄Cl₂F₈
Molecular Mass
270.9360256
Exact Mass
269.92493112
Charge
0
InChI
InChI=1S/C4Cl2F8/c5-3(11,12)1(7,8)2(9,10)4(6,13)14
InChIKey
LGBGVSJBKFDYKH-UHFFFAOYSA-N
Canonic Smiles
FC(C(C(Cl)(F)F)(F)F)(C(Cl)(F)F)F
Isomeric Smiles
C(C(C(C(Cl)(F)F)(F)F)(F)F)(Cl)(F)F
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
3.8963761
LogD (pH = 7.4)
3.8963761
Log P
3.8963761
Molar Refractivity
31.8748
Polarizability
12.136961
Polar Surface Area
0.0
Rotatable Bonds
3
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 Traditional name
•
IUPAC name
•
Synonyms
Registration numbers
•
PubChem SID
•
PubChem CID
•
MDL Number
•
CAS Number
Properties
•
Physical Property
•
Safety Information
•
Product Information
Related Proteins
Molecular Spectra
Molecule Details
References
•
PubChem Literature
•
From Data Sources
Bioactivity
•
PubChem BioAssay
Data Source
Commercial Catalog
Matrix Scientific
008902
Academic Data
PubChem
67729
Names and Identifiers
IUPAC Traditional name
1,4-dichloro-1,1,2,2,3,3,4,4-octafluorobutane
IUPAC name
1,4-dichloro-1,1,2,2,3,3,4,4-octafluorobutane
Synonyms
1,4-Dichlorooctafluorobutane
Registration numbers
PubChem SID
160975205
PubChem CID
67729
MDL Number
MFCD00155749
CAS Number
679-85-6
References
PubChem Literature
No Data Available
Click here to submit data
Bioactivity
PubChem BioAssay
Properties
Physical Property
Boiling Point
64-65.5°C
Source
Safety Information
TSCA Listed
false
Source
Storage Warning
IRRITANT
Source
MSDS Link
Download link
Source
Product Information
99%
Source
Purity