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Substance Name: Propicillin [INN:BAN:DCF]
RN: 551-27-9
UNII: 8X1R260V33
InChIKey: HOCWPKXKMNXINF-XQERAMJGSA-N

Classification Codes

  • Anti-Bacterial Agents
  • Anti-Infective Agents

Molecular Formula

  • C18-H22-N2-O5-S

Molecular Weight

  • 378.4468
 
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Names and Synonyms

Name of Substance

  • Propicillin
  • Propicillin [INN:BAN:DCF]

Synonyms

  • EINECS 208-995-5
  • Propicilina
  • Propicilina [INN-Spanish]
  • Propicillin
  • Propicilline
  • Propicilline [INN-French]
  • Propicillinum
  • Propicillinum [INN-Latin]
  • UNII-8X1R260V33

Systematic Names

  • (1-Phenoxypropyl)penicillin
  • Propicillin

Registry Numbers

CAS Registry Number

  • 551-27-9

FDA UNII

  • 8X1R260V33

System Generated Number

  • 0000551279

Structure Descriptors

InChI

InChI=1S/C18H22N2O5S/c1-4-11(25-10-8-6-5-7-9-10)14(21)19-12-15(22)20-13(17(23)24)18(2,3)26-16(12)20/h5-9,11-13,16H,4H2,1-3H3,(H,19,21)(H,23,24)/t11?,12-,13+,16-/m1/s1

InChIKey

HOCWPKXKMNXINF-XQERAMJGSA-N

Smiles

CCC(Oc1ccccc1)C(=O)N[C@H]2[C@H]3SC(C)(C)[C@@H](N3C2=O)C(=O)O

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 2.65 (none)   EXP
Water Solubility 22.7 mg/L 25 EST
Vapor Pressure 3.25E-13 mm Hg 25 EST
Henry's Law Constant 7.79E-15 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 1.00E-10 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.