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Molecule
ID:90750
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General Information
Structure
Molecular Formula
C₂₄H₂₂
Molecular Mass
310.43148
Exact Mass
310.1721507
Charge
0
InChI
InChI=1S/C24H22/c1-19-7-3-5-9-23(19)17-15-21-11-13-22(14-12-21)16-18-24-10-6-4-8-20(24)2/h3-18H,1-2H3
InChIKey
QKLPIYTUUFFRLV-UHFFFAOYSA-N
Canonic Smiles
Cc1ccccc1/C=C/c1ccc(cc1)/C=C/c1ccccc1C
Isomeric Smiles
Cc1c(cccc1)/C=C/c1ccc(cc1)/C=C/c1ccccc1C
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
7.6797705
LogD (pH = 7.4)
7.6797705
Log P
7.6797705
Molar Refractivity
107.05
Polarizability
40.471416
Polar Surface Area
0.0
Rotatable Bonds
4
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
No Data Available
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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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General Information
Calculated Properties
•
RDKit
•
JChem
Data Source
•
Commercial Catalog
•
Academic Data
Names and Identifiers
•
Synonyms
•
IUPAC Traditional name
•
IUPAC name
Registration numbers
Properties
•
Safety Information
•
Physical Property
•
Product Information
Related Proteins
Molecular Spectra
Molecule Details
•
MP Biomedicals
•
Sigma Aldrich
References
•
PubChem Literature
•
From Data Sources
Bioactivity
•
PubChem BioAssay
Data Source
Commercial Catalog
MP Biomedicals
02150474
05223916
Sigma Aldrich
M7127
257400
Apollo Scientific
OR61337
Bide Pharmatech
BD54436
Alfa Aesar
A13534
Academic Data
PubChem
5378735
Names and Identifiers
Synonyms
1,1'-(Benzene-1,4-diyldiethene-2,1-diyl)bis(2-methylbenzene)
1,4-Bis[2-(2-methylphenyl)vinyl]benzene
1,4-Bis[2-(2-methylphenyl)ethenyl]benzene
1,4-Bis(2-methylstyryl)benzene
Bis-MSB
1,4-Bis(2-methylstyryl )benzene
1,4-双-(2-甲基苯乙烯基)苯
p-bis-(o-METHYLSTYRYL) BENZENE
1,4-Bis(2-methylstyryl)benzene
P-BIS(O-METHYLSTYRYL)BENZENE
1,4-双(2-甲基苯乙烯基 )苯
1,4-Bis(2-methylstyryl)benzene
1,4-Di(2-methylstyryl)benzene
IUPAC Traditional name
1-methyl-2-(2-{4-[2-(2-methylphenyl)ethenyl]phenyl}ethenyl)benzene
1-methyl-2-[(E)-2-{4-[(E)-2-(2-methylphenyl)ethenyl]phenyl}ethenyl]benzene
IUPAC name
1-methyl-2-(2-{4-[2-(2-methylphenyl)ethenyl]phenyl}ethenyl)benzene
1-methyl-2-[(E)-2-{4-[(E)-2-(2-methylphenyl)ethenyl]phenyl}ethenyl]benzene
Registration numbers
CAS Number
13280-61-0
MDL Number
MFCD00008529
EC Number
236-285-5
Beilstein Number
2375845
PubChem SID
24855585
162077483
PubChem CID
5378735
Properties
Safety Information
Storage Warning
Harmful/Irritant/Light Sensitive/Air Sensitive/Store under Argon/Keep Cold
Source
Light Sensitive
Source
Storage Condition
0°C
Source
MSDS Link
Download link
Source
Download link
Source
Download link
来源
GHS Signal Word
Warning
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
Safety Statements
26
Source
26
-
60
Source
German water hazard class
3
Source
GHS Precautionary statements
P305+P351+P338
Source
P280
-
P264
-
P305+P351+P338
-
P337+P313
Source
GHS Hazard statements
H302
-
H319
-
H413
Source
H319
Source
Risk Statements
22
-
36
Source
36
Source
Storage Temperature
-20°C
Source
European Hazard Symbols
Harmful (Xn)
Source
Irritant (Xi)
来源
Personal Protective Equipment
Eyeshields, Gloves, type N95 (US), type P1 (EN143) respirator filter
Source
TSCA Listed
是
Source
Physical Property
Melting Point
180-182°C
Source
180-182 °C(lit.)
Source
179-184°C
Source
Apperance
green
Source
Absorption Wavelength
λmax 349 nm
Source
Product Information
Certificate of Analysis
Download link
Source
Download link
Source
Linear Formula
(CH3C6H4CH=CH)2C6H4
Source
Purity
≥99.5%
Source
98%
Source
99%
Source
Molecule Details
MP Biomedicals
02150474
Green crystals
Used for liquid scintillation spectrometry.
05223916
MP Biomedicals Rare Chemical collection
Sigma Aldrich
257400
Application
Suitable as laser dye
References
PubChem Literature
No Data Available
Click here to submit data
Bioactivity
PubChem BioAssay
Registration numbers
•
CAS Number
•
MDL Number
•
EC Number
•
Beilstein Number
•
PubChem SID
•
PubChem CID