Chemical Properties of Bupivacaine (CAS 38396-39-3)

InChI

InChI=1S/C18H28N2O/c1-4-5-12-20-13-7-6-11-16(20)18(21)19-17-14(2)9-8-10-15(17)3/h8-10,16H,4-7,11-13H2,1-3H3,(H,19,21)

InChI Key

LEBVLXFERQHONN-UHFFFAOYSA-N

Formula

C18H28N2O

SMILES

CCCCN1CCCCC1C(O)=Nc1c(C)cccc1C

Molecular Weight¹

288.43

CAS

38396-39-3

Other Names

• (.+/-.)-1-Butyl-2',6'-pipecoloxylidide
• (.+/-.)-Bupivacaine
• (±)-1-butyl-N-(2,6-dimethylphenyl)piperidine-2-carboxamide
• (±)-1-butyl-N-(2,6-dimethylphenyl)piperidine-2-carboxamide
• 1-Butyl-2',6'-pipecoloxylidide
• 1-Butyl-N-(2,6-dimethylphenyl)-2-piperidinecarboxamide
• 2',6'-Pipecoloxylidide, 1-butyl-
• 2-Piperidinecarboxamide, 1-butyl-N-(2,6-dimethylphenyl)-
• 2-Piperidinecarboxamide, 1-butyl-N-(2,6-dimethylphenyl)-, (.+/-.)-
• Anekain
• Carbostesin
• DL-Bupivacaine
• Marcaine
• Win 11318
• bupibacaine
• dl-1-Butyl-2',6'-pipecoloxylidide

• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• T_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Similar Compounds

Find more compounds similar to Bupivacaine.

Sources

• Crippen Method
• Aqueous Solubility Prediction Method
• McGowan Method
• NIST Webbook

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