Dibenzyl L-glutamate 4-methylbenzenesulfonate (1:1)

Basic Information

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CAS Number

2791-84-6

Molecular Formula

C26H29NO7S

Molecular Weight

499.59 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 Amines

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

Melting Point

144-147°C

Boiling Point

453.5°C at 760 mmHg

Flash Point

165.6°C

Specific Rotation

+7.2° (c=1 in EtOH)

SMILES

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CC1=CC=C(C=C1)S(=O)(=O)O.C1=CC=C(C=C1)COC(=O)CCC(C(=O)OCC2=CC=CC=C2)N

InChI

InChI=1S/C19H21NO4.C7H8O3S/c20-17(19(22)24-14-16-9-5-2-6-10-16)11-12-18(21)23-13-15-7-3-1-4-8-15;1-6-2-4-7(5-3-6)11(8,9)10/h1-10,17H,11-14,20H2;2-5H,1H3,(H,8,9,10)/t17-;/m0./s1

InChIKey

HVZUAIVKRYGQRM-LMOVPXPDSA-N

LogP

3.822420000000003

Topological Polar Surface Area

132.99 Å²

Hydrogen Bond Donor/Acceptor

3 / 8

Complexity

593

Safety Information

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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

H-Glu(OBzl)-OBzl.Tos-OH
CS-W011501
Dibenzyl L-glutamate p-toluenesulfonate
Glutamic acid, dibenzyl ester, p-toluenesulfonate, L-
Dibenzyl L-glutamate tosylate
glutamic acid dibenzyl ester tosylate
[(2S)-1,5-dioxo-1,5-bis(phenylmethoxy)pentan-2-yl]azanium;4-methylbenzenesulfonate
FD21435
HY-W010785
2791-84-6
SCHEMBL1517939
AKOS015924097
L-Glutamic acid, bis(phenylmethyl) ester, 4-methylbenzenesulfonate
(S)-Dibenzyl 2-aminopentanedioate 4-methylbenzenesulfonate
L-glutamic acid 1,5-dibenzyl ester p-toluenesulfonate
HVZUAIVKRYGQRM-LMOVPXPDSA-N
MFCD00038980
H-Glu(OBzl)-OBzl.TosOH
Glu(OBzl)-OBzl.TosOH
AS-12241
(+)-glutamic acid dibenzyl ester p-toluenesulfonate
L-glutamic acid dibenzyl ester p-toluenesulfonate salt
Glutamic acid, dibenzyl ester, p-toluenesulfonate
Q-101537
A819246
dibenzyl (2S)-2-aminopentanedioate;4-methylbenzenesulfonic acid
L-GLUTAMIC ACID DIBENZYL ESTER 4-TOLUENESULFONATE
L-Glutamic acid dibenzyl ester p-toluenesulfonate
AC-19203
H-Glu(OBzl)-OBzl . p-tosylate
H-GLU(OBZL)-OBZL P-TOSYLATE

MDL Number

MFCD00038980

Customs Code

2922499990

FAQ

What regulatory guidelines apply to Dibenzyl L-glutamate 4-methylbenzenesulfonate (1:1) (CAS: 2791-84-6)?

Dibenzyl L-glutamate 4-methylbenzenesulfonate (1:1) (CAS: 2791-84-6) is regulated under the Globally Harmonized System of Classification and Labeling of Chemicals (GHS) as a hazardous substance. It is also subject to the Registration, Evaluation, Authorization, and Restriction of Chemicals (REACH) in the European Union, which requires manufacturers and importers to register substances with the European Chemicals Agency (ECHA). Additionally, the U.S. Food and Drug Administration (FDA) and the U.S. Environmental Protection Agency (EPA) have specific regulations related to the use of this compound in food additives and environmental releases, respectively.

Are there alternatives to Dibenzyl L-glutamate 4-methylbenzenesulfonate (1:1) in synthesis?

There are several alternatives to Dibenzyl L-glutamate 4-methylbenzenesulfonate (1:1) (CAS: 2791-84-6) in synthesis, including other glutamate derivatives and sulfonate esters. Common alternatives include other dibenzyl compounds and L-glutamate derivatives with different sulfonate groups. These alternatives can offer similar functionalities but with potentially different reactivity and stability profiles.

What is the market or research trend for Dibenzyl L-glutamate 4-methylbenzenesulfonate (1:1) (CAS: 2791-84-6)?

The market for Dibenzyl L-glutamate 4-methylbenzenesulfonate (1:1) (CAS: 2791-84-6) is currently stable, with a focus on its applications in pharmaceuticals and agrochemicals. Research trends are exploring its potential in novel drug delivery systems and as a preservative. Price trends are influenced by production costs and demand from these industries. Emerging research is also looking at its environmental impact and safety in various applications.

How should waste containing Dibenzyl L-glutamate 4-methylbenzenesulfonate (1:1) (CAS: 2791-84-6) be handled?

Waste containing Dibenzyl L-glutamate 4-methylbenzenesulfonate (1:1) (CAS: 2791-84-6) should be collected in appropriate containers and stored in a secure area away from ignition sources. Proper disposal methods include incineration or professional waste disposal by a licensed facility. Environmental protection measures include ensuring no leaks occur during handling and storage to prevent contamination of soil and water. It is important to follow local regulations and guidelines for waste disposal to ensure safety and compliance.