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Molecule
ID:73326
Structure
Similarity
Functional Group
Text
General Information
Structure
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Molecular Formula
C₁₉H₁₆
Molecular Mass
244.33034
Exact Mass
244.12520051
Charge
0
InChI
InChI=1S/C19H16/c1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18/h1-15,19H
InChIKey
AAAQKTZKLRYKHR-UHFFFAOYSA-N
Canonic Smiles
c1ccc(cc1)C(c1ccccc1)c1ccccc1
Isomeric Smiles
c1c(cccc1)C(c1ccccc1)c1ccccc1
Calculated Properties
JChem
LogD (pH = 7.4)
5.49
LogD (pH = 5.5)
5.49
Log P
5.49
Rotatable Bonds
3
H Donor
0
H Acceptors
0
Lipinski's Rule of Five
false
Polar Surface Area
0.00
Polarizability
28.44
Molar Refractivity
80.44
LOG S
-4.74
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
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Molecule Details
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References
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Bioactivity
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General Information
Calculated Properties
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RDKit
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JChem
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Academic Data
Names and Identifiers
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Synonyms
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IUPAC Traditional name
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IUPAC name
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Properties
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Physical Property
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Safety Information
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Product Information
Related Proteins
Molecular Spectra
Molecule Details
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MP Biomedicals
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Wikipedia
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ChEBI
References
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PubChem Literature
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From Data Sources
Bioactivity
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PubChem BioAssay
Data Source
Commercial Catalog
Apollo Scientific
OR0040
MP Biomedicals
02157114
05219570
Sigma Aldrich
T4521
101303
93050
Alfa Aesar
A11710
Academic Data
Wikipedia
Triphenylmethane
PubChem
10614
ChEBI
CHEBI:76212
Names and Identifiers
Synonyms
Triphenylmethane
1,1',1''-Methanetriyltribenzene
Triphenylmethane
三苯甲烷
Tritan
1,1',1"-Methylidynetrisbenzene
1,1,1-triphenylmethane
Tritane
triphenylmethane
1,1',1''-methylidynetrisbenzene
IUPAC Traditional name
triphenylmethane
IUPAC name
(diphenylmethyl)benzene
Registration numbers
EC Number
208-275-0
CAS Number
519-73-3
Merck Index
149741
MDL Number
MFCD00004763
Beilstein Number
1909753
PubChem CID
10614
PubChem SID
162038246
24889780
24846537
170474438
Chemspider ID
10169
Wikipedia Title
Triphenylmethane
PubMed Citation Links
23865508
24136473
23053116
23008002
22573270
23341885
ACToR Database
519-73-3
25954-71-6
SureChEMBL Database
SCHEMBL144
Reaxys Registry
1909753
CHEBI ID
CHEBI:76212
UniProt Database
A0QUZ4
NMRShiftDB Database
10016568
CompTox Database
DTXSID3060164
Molecule Details
MP Biomedicals
02157114
Purity: 90%
05219570
MP Biomedicals Rare Chemical collection
Wikipedia
Triphenylmethane
Sigma Aldrich
101303
Packaging
25, 100, 500 g in poly bottle
ChEBI
CHEBI:76212
A triarylmethane in which the three aryl groups are phenyl. It forms the basic skeleton of several synthetic dyes.
References
PubChem Literature
No Data Available
Click here to submit data
Bioactivity
PubChem BioAssay
Registration numbers
•
EC Number
•
CAS Number
•
Merck Index
•
MDL Number
•
Beilstein Number
•
PubChem CID
•
PubChem SID
•
Chemspider ID
•
Wikipedia Title
•
PubMed Citation Links
•
ACToR Database
•
SureChEMBL Database
•
Reaxys Registry
•
CHEBI ID
•
UniProt Database
•
NMRShiftDB Database
•
CompTox Database
Properties
Physical Property
Boiling Point
358-359°C/754mm
Source
358-354°C @ 754 nm Hg
Source
359 °C
Source
358-359 °C/754 mmHg(lit.)
Source
358-359°C
Source
Melting Point
92-94°C
Source
91-94°C
Source
92°C
Source
92-94 °C
Source
92-94 °C(lit.)
Source
92-94°C
Source
Density
1.014
Source
1.014 g/ml
Source
1.014 g/cm
3
Source
1.014 g/mL at 25 °C(lit.)
Source
1.010
Source
Solubility
insoluble in water
Source
dioxane: soluble0.1 g/mL, clear
Source
p𝘒ₐ
33
Source
Safety Information
Storage Warning
Irritant
Source
Storage Condition
2-8°C
Source
MSDS Link
Download link
Source
Download link
Source
Download link
Source
Download link
Source
R36 37 38
Source
2-8°C
Source
3
Source
Eyeshields, Gloves, type N95 (US), type P1 (EN143) respirator filter
Source
是
Source
Product Information
Certificate of Analysis
Download link
Source
Download link
Source
Purity
90%
Source
99%
Source
≥97.0% (HPLC)
Source
98%
Source
(C6H5)3CH
Source
purum
Source
Risk Statements
Storage Temperature
German water hazard class
Personal Protective Equipment
TSCA Listed
Linear Formula
Grade