tert-Butyl 4-(chloromethyl)-5,6-dihydropyridine-1(2H)-carboxylate

Base Information

• Chemical Name: tert-Butyl 4-(chloromethyl)-5,6-dihydropyridine-1(2H)-carboxylate
• CAS No.: 159635-23-1
• Molecular Formula: C₁₁H₁₈ClNO₂
• Molecular Weight: 231.722
• DSSTox Substance ID: DTXSID901149547
• Nikkaji Number: J746.717F

Synonyms:159635-23-1;tert-Butyl 4-(chloromethyl)-5,6-dihydropyridine-1(2H)-carboxylate;tert-Butyl4-(chloromethyl)-5,6-dihydropyridine-1(2H)-carboxylate;1(2H)-Pyridinecarboxylic acid, 4-(chloromethyl)-3,6-dihydro-, 1,1-dimethylethyl ester;SCHEMBL2003552;KYOKRJHUYDGZDR-UHFFFAOYSA-N;DTXSID901149547;SB55060;FT-0707917;E88158;1,1-Dimethylethyl 4-(chloromethyl)-3,6-dihydro-1(2H)-pyridinecarboxylate;4-Chloromethyl-3,6-dihydro-2H-pyridine-1-carboxylic acid tert-butyl ester;1-[(1,1-dimethylethoxy)carbonyl]-4-chloromethyl-1,2,5,6-tetrahydropyridine;4-(Chloromethyl)-3,6-dihydropyridine-1(2H)-carboxylic acid tert-butyl ester

Chemical Property of tert-Butyl 4-(chloromethyl)-5,6-dihydropyridine-1(2H)-carboxylate

Chemical Property:

• XLogP3: 1.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 231.1026065
• Heavy Atom Count: 15
• Complexity: 268

Purity/Quality:

98%min ^*data from raw suppliers

Safty Information:

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MSDS Files:

Useful:

• Canonical SMILES: CC(C)(C)OC(=O)N1CCC(=CC1)CCl

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