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3,4-Dichloromethylphenidate

Base Information Edit
  • Chemical Name:3,4-Dichloromethylphenidate
  • CAS No.:1400742-68-8
  • Molecular Formula:C14H17Cl2NO2
  • Molecular Weight:302.196
  • Hs Code.:
  • DSSTox Substance ID:DTXSID30658831
  • Nikkaji Number:J3.574.030I
  • Wikipedia:3,4-Dichloromethylphenidate
  • Wikidata:Q4634059
  • Pharos Ligand ID:K88HBULD9F19
  • ChEMBL ID:CHEMBL220195
  • Mol file:1400742-68-8.mol
3,4-Dichloromethylphenidate

Synonyms:3,4-Dichloromethylphenidate;CHEMBL220195;1400742-68-8;3,4-CTMP HCl salt;methyl 2-(3,4-dichlorophenyl)-2-piperidin-2-ylacetate;SCHEMBL15655500;DTXSID30658831;1400742-68-8 (freebase);BDBM50202391;PD093206;J3.574.030I;Q4634059;(RS/SR)-methyl 2-(3,4-dichlorophenyl)-2-(piperidin-2-yl)acetate;2-(3,4-Dichlorophenyl)-2-(piperidine-2-yl)acetic acid methyl ester;methyl 2-(3,4-dichlorophenyl)-2-(piperidin-2-yl)acetate hydrochloride

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Chemical Property of 3,4-Dichloromethylphenidate Edit
Chemical Property:
  • XLogP3:1.5
  • Hydrogen Bond Donor Count:1
  • Hydrogen Bond Acceptor Count:3
  • Rotatable Bond Count:4
  • Exact Mass:301.0636342
  • Heavy Atom Count:19
  • Complexity:314
Purity/Quality:
Safty Information:
  • Pictogram(s):  
  • Hazard Codes: 
MSDS Files:

SDS file from LookChem

Useful:
  • Canonical SMILES:COC(=O)C(C1CCCCN1)C2=CC(=C(C=C2)Cl)Cl