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2-Chlorotrityl chloride

CAT: 0931-T67607-01Size: 1 mL - 10 mM (in DMSO)Dry Ice: NoHazardous: No
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CAT#:0931-T67607-01Size:1 mL - 10 mM (in DMSO)
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
42074-68-0
Target
Others
Related Pathways
Others
Purity
0.9936
Bioactivity
2-Chlorotrityl chloride is an aromatic compound for biochemical experiments and drug synthesis research.
Smiles
ClC=1C=CC=CC1C(Cl)(C=2C=CC=CC2)C=3C=CC=CC3
Molecular Formula
C19H14Cl2
Molecular Weight
313.22
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

2-Chlorotrityl chloride

structure given in first source

CAS Number42074-68-0
PubChem CID94524
IUPAC Name1-chloro-2-[chloro(diphenyl)methyl]benzene
Molecular FormulaC19H14Cl2
Molecular Weight313.2
XLogP6.2
Topological Polar Surface Area0
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count3
Heavy Atom Count21
Formal Charge0
Complexity298
SMILES
C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3Cl)Cl
InChI
InChI=1S/C19H14Cl2/c20-18-14-8-7-13-17(18)19(21,15-9-3-1-4-10-15)16-11-5-2-6-12-16/h1-14H
InChIKey
JFLSOKIMYBSASW-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-Chlorotrityl chloride
CAS: 42074-68-0
CID: 94524
Formula: C19H14Cl2
MW: 313.2
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight313.2
XLogP36.2
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count3
Exact Mass312.0472558
Monoisotopic Mass312.0472558
Topological Polar Surface Area0 Ų
Heavy Atom Count21
Formal Charge0
Complexity298
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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