Molfinder
Home
Support
About Us
Data Source
Statistics
Blogs
Molecule
ID:94662
Structure
Similarity
Functional Group
Text
General Information
Structure
Molecular Formula
C₁₀H₂₁F
Molecular Mass
160.2721432
Exact Mass
160.16272889
Charge
0
InChI
InChI=1S/C10H21F/c1-2-3-4-5-6-7-8-9-10-11/h2-10H2,1H3
InChIKey
LHLRHWJTTUCDQA-UHFFFAOYSA-N
Canonic Smiles
CCCCCCCCCCF
Isomeric Smiles
FCCCCCCCCCC
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
4.363826
LogD (pH = 7.4)
4.363826
Log P
4.363826
Molar Refractivity
48.0488
Polarizability
18.824186
Polar Surface Area
0.0
Rotatable Bonds
8
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
Loading...
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
Properties
•
Physical Property
•
Safety Information
•
Product Information
Related Proteins
Molecular Spectra
Molecule Details
•
Sigma Aldrich
References
•
PubChem Literature
•
From Data Sources
Bioactivity
•
PubChem BioAssay
Data Source
Commercial Catalog
Apollo Scientific
PC2152
Sigma Aldrich
538655
Academic Data
PubChem
9541
Names and Identifiers
IUPAC name
1-fluorodecane
Synonyms
1-Fluorodecane 98%
1-Fluorodecane
1-氟癸
IUPAC Traditional name
1-fluorodecane
Registration numbers
CAS Number
334-56-5
MDL Number
MFCD00018074
PubChem SID
24878350
162081316
EC Number
206-380-6
PubChem CID
9541
Molecule Details
Sigma Aldrich
538655
Packaging
5 g in glass bottle
References
PubChem Literature
No Data Available
Click here to submit data
Bioactivity
PubChem BioAssay
Registration numbers
•
CAS Number
•
MDL Number
•
PubChem SID
•
EC Number
•
PubChem CID
Properties
Physical Property
Boiling Point
183-187°C
Source
185-187 °C(lit.)
Source
Flash Point
80°C
Source
176 °F
Source
80 °C
Source
Refractive Index
1.4090
Source
n20/D 1.409(lit.)
Source
Density
0.809
Source
0.809 g/mL at 25 °C(lit.)
Source
Safety Information
Storage Warning
Very Toxic
Source
GHS Hazard statements
H300
-
H410
Source
MSDS Link
Download link
Source
Risk Statements
28
-
50/53
Source
28
-
36/37
-
45
-
60
-
61
Source
1
Source
Nature polluting (N)
UN 2810 6.1/PG 1
Source
6.1
Source
Acute toxicity (oral, dermal, inhalation), categories 1,2,3
P264
-
P273
-
P301+P310
-
P501
Source
2810
Source
Danger
Source
Eyeshields, Faceshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter
Source
HD8575000
Source
3
Source
Product Information
Purity
98%
Source
Linear Formula
F(CH2)9CH3
Source
Source
Highly toxic (T+)
Source
Source
Hazardous to the aquatic environment
Acute hazard, category1
Chronic hazard, categories 1,2
Source
Safety Statements
Packing Group
European Hazard Symbols
RID/ADR
Hazard Class
GHS Pictograms
GHS Precautionary statements
UN Number
GHS Signal Word
Personal Protective Equipment
RTECS
German water hazard class