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Diphenylmethyl Mesylate (Technical Grade)

CAT: 0572-TRC-D135510-500MGSize: 500 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-D135510-500MGSize:500 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
135513-20-1
Synonyms
Diphenylmethyl Mesylate
Hazard Statement
No Data Available
Smiles
CS(=O)(=O)OC(c1ccccc1)c2ccccc2
Molecular Formula
C14 H14 O3 S
Molecular Weight
262.324
InChI
InChI=1S/C14H14O3S/c1-18(15,16)17-14(12-8-4-2-5-9-12)13-10-6-3-7-11-13/h2-11,14H,1H3
Additionnal Information
IUPAC name: benzhydryl methanesulfonate
Shipping Conditions
Room Temperature

Chemical Information

Diphenylmethyl Mesylate (Technical Grade)
CAS Number135513-20-1
PubChem CID15105725
IUPAC Namebenzhydryl methanesulfonate
Molecular FormulaC14H14O3S
Molecular Weight262.33
XLogP2.8
Topological Polar Surface Area51.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count4
Heavy Atom Count18
Formal Charge0
Complexity315
SMILES
CS(=O)(=O)OC(C1=CC=CC=C1)C2=CC=CC=C2
InChI
InChI=1S/C14H14O3S/c1-18(15,16)17-14(12-8-4-2-5-9-12)13-10-6-3-7-11-13/h2-11,14H,1H3
InChIKey
QKVUIWDHQSAFHI-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Diphenylmethyl Mesylate (Technical Grade)
CAS: 135513-20-1
CID: 15105725
Formula: C14H14O3S
MW: 262.33
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight262.33
XLogP32.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count4
Exact Mass262.06636548
Monoisotopic Mass262.06636548
Topological Polar Surface Area51.8 Ų
Heavy Atom Count18
Formal Charge0
Complexity315
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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