Acebutolol

Acebutolol
SMILES
CCCC(=O)NC1=CC(=C(C=C1)OCC(CNC(C)C)O)C(=O)C
CAS number
37517-30-9
Formula
C18 H28 N2 O4
Molecular weight
336.43g/mol
Melting point
not specified  tM/°C
Entropy of fusion
not specified  ΔfusS/J K-1 mol-1

Vapor pressure

t/°C PS/Pa PL/Pa log (PL/Pa) method and notes reference
25 2.18E-9 1.87E-8 -7.73 EPI Suite estimation

Water solubility

t/°C SWS/mol m-3 SWL/mol m-3 log (SWL/mol m-3) method and notes reference
not specified

Henry's law constant

t/°C H/Pa m3 mol-1 KAW log (KAW) method and notes reference
25 1.23E-18 -17.9 EPI Suite estimation

Octanol-water partition ratio

t/°C KOW log (KOW) method and notes reference
25 15.5 1.19 EPI Suite estimation

Octanol-air partition ratio

t/°C KOA log (KOA) method and notes reference
25 4.17E+19 19.6 EPI Suite estimation

Half-life for degradation in air

t/°C half-life/day method and notes reference
25 0.1 EPI Suite estimation

Half-life for degradation in water

t/°C half-life/day method and notes reference
25 38 EPI Suite estimation

Half-life for degradation in soil

t/°C half-life/day method and notes reference
25 75 EPI Suite estimation

Half-life for degradation in sediment

t/°C half-life/day method and notes reference
25 338 EPI Suite estimation