Gibberellin A4

Basic Information

View in Editor

CAS Number

468-44-0

Molecular Formula

C19H24O5

Molecular Weight

332.4 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Esters

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

Melting Point

200-211°C

Boiling Point

574℃

Flash Point

>110°(230°F)

Solubility

Soluble in methanol or ethanol. Also soluble in aqueous sodium bicarbonate or sodium acetate

SMILES

View in Editor

CC12C(CCC3(C1C(C45C3CCC(C4)C(=C)C5)C(=O)O)OC2=O)O

InChI

InChI=1S/C19H24O5/c1-9-7-18-8-10(9)3-4-11(18)19-6-5-12(20)17(2,16(23)24-19)14(19)13(18)15(21)22/h10-14,20H,1,3-8H2,2H3,(H,21,22)/t10-,11-,12+,13-,14-,17-,18+,19-/m1/s1

InChIKey

RSQSQJNRHICNNH-NFMPGMCNSA-N

LogP

2.1362

Topological Polar Surface Area

83.83 Å²

Hydrogen Bond Donor/Acceptor

2 / 5

Complexity

685

Safety Information

View Safety Information

Hazard Statement

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Synonyms & References

English

4aalpha,4bbeta-Gibbane-1alpha,10beta-dicarboxylic acid, 2beta,4a-dihydroxy-1-methyl-8-methylene-, 1,4a-lactone
(1R,2R,5R,8R,9S,10R,11S,12S)-12-hydroxy-11-methyl-6-methylidene-16-oxo-15-oxapentacyclo[9.3.2.1(5,8).0(1,10).0(2,8)]heptadecane-9-carboxylic acid
E75836
Q27097025
CHEBI:32902
2beta-hydroxy-1beta-methyl-8-methylidene-13-oxo-4a,1alpha-epoxymethano-4aalpha,4bbeta-gibbane-10beta-carboxylic acid
DTXSID20896861
EINECS 207-406-9
468-44-0
2beta,4a-dihydroxy-1-methyl-8-methylene-4aalpha,4bbeta-gibbane-1alpha,10beta-dicarboxylic acid, 1,4a-lactone
Gibberellic acid A4
1360M56KLC
HY-N8440
(1S,2S,4aR,4bR,7R,9aR,10S,10aR)-2-Hydroxy-1-methyl-8-methylene-13-oxododecahydro-4a,1-(epoxymethano)-7,9a-methanobenzo[a]azulene-10-carboxylic acid
Gibbane-1,10-dicarboxylic acid, 2,4a-dihydroxy-1-methyl-8-methylene-, 1,4a-lactone, (1.alpha.,2.beta.,4a.alpha.,4b.beta.,10.beta.)-
Gibbane-1,10-dicarboxylic acid, 2,4a-dihydroxy-1-methyl-8-methylene-, 1,4a-lactone, (1alpha,2beta,4aalpha,4bbeta,10beta)-
Gibberellin A4
1,4a-lactone
W-106084
(1S,2S,4aR,4bR,7S,9aR,10S,10aR)-2-Hydroxy-1-methyl-8-methylene-13-oxododecahydro-4a,1-(epoxymethano)-7,9a-methanobenzo[a]azulene-10-carboxylic acid
gibberellin 4
NS00015124
SCHEMBL385180
AKOS026751551
(1S,2S,4aR,4bR,7R,9aR,10S,10aR)-2-Hydroxy-1-methyl-8-methylene-13-oxododecahydro-4a,1-(epoxymethano)-7,9a-methanobenzo[a]azulene-10-carboxylicacid
(1S,2S,4aR,4bR,7R,9aR,10S,10aR)-2-hydroxy-1-methyl-8-methylidene-13-oxododecahydro-4a,1-(epoxymethano)-7,9a-methanobenzo[a]azulene-10-carboxylic acid
CS-0144214
4a.alpha.,4b.beta.-Gibbane-1.alpha.,10.beta.-dicarboxylic acid, 2.beta.,4a-dihydroxy-1-methyl-8-methylene-, 1,4a-lactone
NCGC00380182-01
UNII-1360M56KLC
DB07815

MDL Number

MFCD00133363

FAQ

What regulatory guidelines apply to Gibberellin A4 (CAS: 468-44-0)?

Gibberellin A4 (CAS: 468-44-0) falls under the regulatory frameworks of GHS for classification as a hazardous substance. In the EU, it is governed by REACH regulations, requiring manufacturers and importers to register materials with potential health and environmental impacts. FDA and EPA may also have specific handling and reporting requirements for its use in agricultural and pharmaceutical applications.

Are there alternatives to Gibberellin A4 (CAS: 468-44-0) in synthesis?

Gibberellin A4 (CAS: 468-44-0) can be synthesized using various reagents and methods. Common alternatives include other gibberellins like A3 and A7, which may offer similar biological activities. Additionally, analogs such as gibberellic acid methyl ester can be used as substitutes depending on the specific application needs.

What is the market or research trend for Gibberellin A4 (CAS: 468-44-0)?

The market for Gibberellin A4 (CAS: 468-44-0) is growing due to its applications in plant growth regulation and agricultural productivity. Research trends include exploring its use in biotechnology for crop improvement and understanding its mechanisms at the molecular level. Price trends are influenced by demand in agriculture and pharmaceutical sectors, with increasing emphasis on sustainable and eco-friendly alternatives.

How should waste containing Gibberellin A4 (CAS: 468-44-0) be handled?

Waste containing Gibberellin A4 (CAS: 468-44-0) should be collected and disposed of according to local regulations. Incineration is a common method for disposing of hazardous waste, ensuring complete destruction. Professional waste disposal services should be used for safe handling and disposal to prevent environmental contamination. Proper labeling and documentation of the waste are essential for compliance.