Ursonic Acid | CAS No. 6246-46-4

Ursonic Acid

Basic Information

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CAS Number

6246-46-4

Molecular Formula

C30H46O3

Molecular Weight

454.7 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ketones

Fine Chemicals Surfactants Anionic Surfactants

Polymers and Plastics Thermoplastics Polyolefins

Basic Physical Properties

Physical State

Powder

Boiling Point

555.078℃/760mmHg

Solubility

N/A

SMILES

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CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(=O)C5(C)C)C)C)C2C1C)C)C(=O)O

InChI

InChI=1S/C30H46O3/c1-18-10-15-30(25(32)33)17-16-28(6)20(24(30)19(18)2)8-9-22-27(5)13-12-23(31)26(3,4)21(27)11-14-29(22,28)7/h8,18-19,21-22,24H,9-17H2,1-7H3,(H,32,33)/t18-,19+,21+,22-,24+,27+,28-,29-,30+/m1/s1

InChIKey

MUCRYNWJQNHDJH-OADIDDRXSA-N

LogP

7.297700000000008

Topological Polar Surface Area

54.370000000000005 Å²

Hydrogen Bond Donor/Acceptor

1 / 3

Complexity

916

Safety Information

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Storage Conditions

2-8℃

Synonyms & References

English

3-Oxours-12-en-28-oic acid
3-oxo-urs-12-en-28-oic acid
Ursonic acid
3-Ketone
3-oxo-ursolic acid
Ursomic acid
ursonic acd
3-Ketoursolicacid
3-Oxo-12-ursen-28-oic acid
[ "3-Oxo-12-ursen-28-oic acid" ]
3-Ketoursolic acid
BDBM50245647
ST24042406
246O464
HMS3885G12
B8F
HY-N1486
DA-78801
1,2,6a,6b,9,9,12a-Heptamethyl-10-oxo-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-icosahydropicene-4a-carboxylate
Ursonate
s3902
DS-5490
AC-33970
(1S,2R,4aS,6aS,6bR,8aR,12aR,12bR,14bS)-1,2,6a,6b,9,9,12a-heptamethyl-10-oxo-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-icosahydropicene-4a-carboxylic acid
MFCD09752413
Ursonic acid?
CHEMBL487887
CHEBI:172011
6246-46-4
(1S,2R,4aS,6aR,6aS,6bR,8aR,12aR,14bS)-1,2,6a,6b,9,9,12a-heptamethyl-10-oxo-1,2,3,4,5,6,6a,7,8,8a,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid
(1S,2R,4aS,6aS,6bR,8aR,12aR,12bR,14bS)-1,2,6a,6b,9,9,12a-heptamethyl-10-oxo-1,2,3,4,5,6,7,8,8a,11,12,12b,13,14b-tetradecahydropicene-4a-carboxylic acid

MDL Number

MFCD09752413

Customs Code

2918300090

FAQ

What regulatory guidelines apply to Ursonic Acid (CAS: 6246-46-4)?

Ursonic Acid (CAS: 6246-46-4) falls under the purview of regulations such as the Globally Harmonized System (GHS), REACH in the EU, and the Toxic Substances Control Act (TSCA) in the USA. It is classified as a skin and eye irritant under GHS. Companies handling Ursonic Acid must ensure compliance with these regulations, including proper labeling, storage, and reporting of safety data sheets (SDS).

Are there alternatives to Ursonic Acid (CAS: 6246-46-4) in synthesis?

While Ursonic Acid (CAS: 6246-46-4) is a common reagent, alternatives such as acetic anhydride or other carboxylic acid anhydrides can be used in certain syntheses. These alternatives may have different chemical properties, reactivity profiles, and safety considerations, so careful evaluation is necessary to determine the most suitable option for a specific application.

What is the market or research trend for Ursonic Acid (CAS: 6246-46-4)?

Ursonic Acid (CAS: 6246-46-4) continues to be a significant reagent in organic synthesis, particularly in the production of carboxylic acids and their derivatives. Research trends are shifting towards more sustainable and environmentally friendly alternatives, but Ursonic Acid remains a key player. Market trends show steady demand, with price stability and consistent supply, reflecting its essential role in various industries.

How should waste containing Ursonic Acid (CAS: 6246-46-4) be handled?

Waste containing Ursonic Acid (CAS: 6246-46-4) should be collected in appropriate containers and disposed of according to local hazardous waste regulations. Incineration is a common method, but professional waste disposal services are recommended to ensure safe and compliant handling. Proper protective equipment and procedures must be followed to prevent environmental contamination and ensure worker safety.