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Molecule
ID:87563
Structure
Similarity
Functional Group
Text
General Information
Structure
Molecular Formula
C₁₀H₂₁I
Molecular Mass
268.17821
Exact Mass
268.06879867
Charge
0
InChI
InChI=1S/C10H21I/c1-2-3-4-5-6-7-8-9-10-11/h2-10H2,1H3
InChIKey
SKIDNYUZJPMKFC-UHFFFAOYSA-N
Canonic Smiles
CCCCCCCCCCI
Isomeric Smiles
ICCCCCCCCCC
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
5.4430985
LogD (pH = 7.4)
5.4430985
Log P
5.4430985
Molar Refractivity
61.0241
Polarizability
24.001276
Polar Surface Area
0.0
Rotatable Bonds
8
Lipinski's Rule of Five
false
Data Source
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Names and Identifiers
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Registration numbers
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Properties
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Related Proteins
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Molecular Spectra
No Data Available
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Molecule Details
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References
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Bioactivity
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Quote
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General Information
Calculated Properties
•
RDKit
•
JChem
Data Source
•
Commercial Catalog
•
Academic Data
Names and Identifiers
•
Synonyms
•
IUPAC Traditional name
•
IUPAC name
Registration numbers
Properties
•
Physical Property
•
Safety Information
•
Product Information
Related Proteins
Molecular Spectra
Molecule Details
•
MP Biomedicals
•
Apollo Scientific
•
Sigma Aldrich
References
•
PubChem Literature
•
From Data Sources
Bioactivity
•
PubChem BioAssay
Data Source
Commercial Catalog
MP Biomedicals
05203143
Apollo Scientific
OR3175
Sigma Aldrich
238252
TRC
I695000
Enamine
EN300-19408
Bide Pharmatech
BD59127
Alfa Aesar
A16173
Academic Data
PubChem
16314
Names and Identifiers
Synonyms
Decyl iodide
1-Iododecane
1-碘癸烷
1-Iododecane
癸基碘
1-Decyl Iodide
n-Decyl Iodide
n-DECYL IODIDE
IUPAC Traditional name
1-iododecane
IUPAC name
1-iododecane
Molecule Details
MP Biomedicals
05203143
MP Biomedicals Rare Chemical collection
Apollo Scientific
OR3175
Stabilised with copper
Sigma Aldrich
238252
Packaging
25, 100 g in glass bottle
References
PubChem Literature
No Data Available
Click here to submit data
Bioactivity
PubChem BioAssay
Properties
Physical Property
Flash Point
96°C
Source
110 °C
Source
230 °F
Source
96°C(204°F)
Source
Density
1.257
Source
1.257 g/mL at 25 °C(lit.)
Source
Melting Point
-16°C
Source
35 - 37°C
Source
-16°C
Source
1.485
Source
n20/D 1.485(lit.)
Source
1.4850
Source
132°C/15mm
Source
132 °C/15 mmHg(lit.)
Source
264°C
Source
0.01 mmHg ( 20 °C)
Source
>5 (vs air)
Source
6.227
Source
Safety Information
Irritant/Light Sensitive/Keep Cold
Source
Light Sensitive
Source
S:
20
-
25
-
26
-
37/39
Source
26
Product Information
Download link
Source
Download link
Source
CH3(CH2)9I
Source
98%
Source
95%
Source
95+%
Source
Source
26
-
37
Source
MSDS Link
Download link
Source
Download link
Source
Download link
Source
European Hazard Symbols
Irritant (Xi)
Source
Risk Statements
R:
36/37/38
Source
36/37/38
Source
36/38
Source
GHS Pictograms
Acute toxicity (oral, dermal, inhalation), category 4
Skin irritation, category 2
Eye irritation, category 2
Skin sensitisation, category 1
Specific Target Organ Toxicity – Single exposure, category 3
Source
GHS Signal Word
Warning
Source
German water hazard class
3
Source
GHS Precautionary statements
P261
-
P305+P351+P338
Source
P280G-
P305+P351+P338
Source
GHS Hazard statements
H315
-
H319
-
H335
-
H413
Source
H315
-
H319
Source
Personal Protective Equipment
Eyeshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter
Source
RTECS
HD8705000
Source
TSCA Listed
是
Source
98%, stab. with copper
Source
Contains
copper as stabilizer
Source
Refractive Index
Boiling Point
Vapor Pressure
Vapor Density
Hydrophobicity(logP)
Storage Warning
Safety Statements
Certificate of Analysis
Linear Formula
Purity
Registration numbers
PubChem SID
162074603
24854150
PubChem CID
16314
Beilstein Number
1735228
MDL Number
MFCD00001085
CAS Number
2050-77-3
EC Number
218-104-1
Related Proteins
Related Proteins
Registration numbers
•
PubChem SID
•
PubChem CID
•
Beilstein Number
•
MDL Number
•
CAS Number
•
EC Number
No Data Available
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