Chemical Properties of Gibberellic acid (CAS 77-06-5)

InChI

InChI=1S/C19H22O6/c1-9-7-17-8-18(9,24)5-3-10(17)19-6-4-11(20)16(2,15(23)25-19)13(19)12(17)14(21)22/h4,6,10-13,20,24H,1,3,5,7-8H2,2H3,(H,21,22)

InChI Key

IXORZMNAPKEEDV-UHFFFAOYSA-N

Formula

C19H22O6

SMILES

C=C1CC23CC1(O)CCC2C12C=CC(O)C(C)(C(=O)O1)C2C3C(=O)O

Molecular Weight¹

346.37

CAS

77-06-5

Other Names

• (+)-Gibberillic acid
• (1«alpha»,2«beta»,4a«alpha»,4b«beta»,10«beta»)-2,4a,7-Trihydroxy-1-methyl-8-methylgibb-3-ene-1,10-dicarboxylic acid 1,4a-lactone
• (1«alpha»,2«beta»,4a«alpha»,4b«beta»,10«beta»)-2,4a,7-Trihydroxy-1-methyl-8-methylgibb-3-ene-1,10-dicarboxylic acid 1,4a-lactone
• (3S,3aS,4S,4aS,6S,8aR,8bR,11S)-6,11-dihydroxy-3-methyl-12-methylene-2-oxo-4a,6-ethano-3,8b-prop-1-enoperhydroindeno[1,2-b]furan-4-carboxylic acid
• 2,4a,7-Trihydroxy-1-methyl-8-methylenegibb-3-ene-1,10-dicarboxylic acid, 1,4a-lactone, (1«alpha»,2«beta»,4a«alpha»,4b«beta»,10«beta»)-
• 2,4a,7-Trihydroxy-1-methyl-8-methylenegibb-3-ene-1,10-dicarboxylic acid, 1,4a-lactone, (1«alpha»,2«beta»,4a«alpha»,4b«beta»,10«beta»)-
• 4a,1-(Epoxymethano)-7,9a-methanobenz[a]azulene, gibb-3-ene-1,10-dicarboxylic acid deriv.
• Activol
• Berelex
• Brellin
• Cekugib
• GA
• GA3
• Gib-Sol
• Gib-Tabs
• Gibb-3-ene-1,10-dicarboxylic acid, 2,4a,7-trihydroxy-1-methyl-8-methylene-, 1,4a-lactone, (1«alpha»,2«beta»,4a«alpha»,4b«beta»,10«beta»)-
• Gibb-3-ene-1,10-dicarboxylic acid, 2,4a,7-trihydroxy-1-methyl-8-methylene-, 1,4a-lactone, (1«alpha»,2«beta»,4a«alpha»,4b«beta»,10«beta»)-
• Gibb-tabs
• Gibberellic acid GA3
• Gibberellin
• Gibberellin A3
• Gibberellin X
• Gibberillic acid
• Gibrescol
• Gibreskol
• Grocel
• NCI-C55823
• NSC 14190
• Pro-Gibb
• Pro-Gibb Plus
• Regulex
• Ryzup

• ω : Acentric Factor.
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fG° : Standard Gibbs free energy of formation (kJ/mol).
• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• Δ_vapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
• IE : Ionization energy (eV).
• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• P_c : Critical Pressure (kPa).
• T_boil : Normal Boiling Point Temperature (K).
• T_c : Critical Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• V_c : Critical Volume (m³/kmol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1037.81; 1433.87]	J/mol×K	[1086.81; 1331.37]
Cp,gas	1037.81	J/mol×K	1086.81	Joback Calculated Property
Cp,gas	1086.39	J/mol×K	1127.57	Joback Calculated Property
Cp,gas	1141.06	J/mol×K	1168.33	Joback Calculated Property
Cp,gas	1202.48	J/mol×K	1209.09	Joback Calculated Property
Cp,gas	1271.31	J/mol×K	1249.85	Joback Calculated Property
Cp,gas	1348.22	J/mol×K	1290.61	Joback Calculated Property
Cp,gas	1433.87	J/mol×K	1331.37	Joback Calculated Property

Similar Compounds

Find more compounds similar to Gibberellic acid.

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Joback Method
• Aqueous Solubility Prediction Method
• McGowan Method
• NIST Webbook

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