(2R,3S)-2-{(1R)-1-[3,5-Bis(trifluoromethyl)phenyl]ethoxy}-3-(4-fluorophenyl)morpholine 4-methylbenzenesulfonate (1:1)

Basic Information

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CAS Number

200000-59-5

Molecular Formula

C27H26F7NO5S

Molecular Weight

609.56 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Fine Chemicals Specialty Chemicals UV Stabilizers

Agricultural Chemicals Pesticides Herbicides

Laboratory Chemicals Research Chemicals Biochemical Reagents

Basic Physical Properties

SMILES

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Cc1ccc(cc1)S(=O)(=O)O.Fc1ccc(cc1)[C@@H]1NCCO[C@@H]1O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C

InChI

InChI=1S/C20H18F7NO2.C7H8O3S/c1-11(13-8-14(19(22,23)24)10-15(9-13)20(25,26)27)30-18-17(28-6-7-29-18)12-2-4-16(21)5-3-12;1-6-2-4-7(5-3-6)11(8,9)10/h2-5,8-11,17-18,28H,6-7H2,1H3;2-5H,1H3,(H,8,9,10)/t11-,17+,18-;/m1./s1

InChIKey

SQSDKFVTNMLFGV-YNXGUESPSA-N

LogP

6.869820000000005

Topological Polar Surface Area

84.86000000000001 Å²

Hydrogen Bond Donor/Acceptor

2 / 6

Complexity

733

Safety Information

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Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

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

(2R,3S)-2-((R)-1-(3,5-Bis(trifluoromethyl)phenyl)ethoxy)-3-(4-fluorophenyl)morpholine 4-methylbenzenesulfonate
(2R,3S)-2-((1R)-1-(3,5-BIS(TRIFLUOROMETHYL)PHENYL)ETHOXY)-3-(4-FLUOROPHENYL)MORPHOLINE 4-METHYLBENZENESULFONATE
(2R,3S)-2-[(1R)-1-[3,5-BIS(TRIFLUOROMETHYL)PHENYL]ETHOXY]-3-(4-FLUOROPHENYL)MORPHOLINE 4-METHYLBENZENESULFONATE
(2R,3S)-2-[(1R)-l-[3,5-Bis(trifluoromethyl)phenyl]ethoxy]-3-(4-fluorophenyl)-morpholine, 4-methylbenzenesulfonate
(2R,3S)-2-[(1R)-1-[3,5-bis(trifluoromethyl)phenyl]ethoxy]-3-(4-fluorophenyl)morpholine,4-methylbenzenesulfonic acid
Morpholine,2-[(1R)-1-[3,5-bis(trifluoromethyl)phenyl]ethoxy]-3-(4-fluorophenyl)-,(2R,3S)-,4-methylbenzenesulfonate
C27H26F7NO5S
SQSDKFVTNMLFGV-YNXGUESPSA-N
BCP07703
0283AB
ST2402238
Morpholine,2-[(1R)-1-[3,5-bis(trifluoromethyl)phenyl]ethoxy]-3-(4-fluorophenyl)-,(2
(2R,3S)-2-[(1R)-1-[3,5-Bis(trifluoromethyl)phenyl]ethoxy]-3-(4-fluorophenyl)morpholine;4-methylbenze

MDL Number

MFCD13183777

FAQ

What regulatory guidelines apply to (2R,3S)-2-{(1R)-1-[3,5-Bis(trifluoromethyl)phenyl]ethoxy}-3-(4-fluorophenyl)morpholine 4-methylbenzenesulfonate (1:1) (CAS: 200000-59-5)?

This compound (CAS: 200000-59-5) falls under the scope of various regulatory guidelines including the Globally Harmonized System of Classification and Labelling of Chemicals (GHS), REACH (Registration, Evaluation, Authorisation and Restriction of Chemicals) for European Union manufacturers and importers, and FDA/EPA standards for safety and environmental protection. Specific hazards and safe handling instructions should be adhered to as per GHS classification.

Are there alternatives to (2R,3S)-2-{(1R)-1-[3,5-Bis(trifluoromethyl)phenyl]ethoxy}-3-(4-fluorophenyl)morpholine 4-methylbenzenesulfonate (1:1) (CAS: 200000-59-5) in synthesis?

Alternative reagents such as morpholine derivatives, sulfonate esters, and other fluorinated compounds can be explored as substitutes. Isomers like the (2S,3R)-isomer may also serve as viable alternatives in certain synthetic pathways.

What is the market or research trend for (2R,3S)-2-{(1R)-1-[3,5-Bis(trifluoromethyl)phenyl]ethoxy}-3-(4-fluorophenyl)morpholine 4-methylbenzenesulfonate (1:1) (CAS: 200000-59-5)?

The compound (CAS: 200000-59-5) is currently being researched for its potential use in pharmaceuticals and as a functional material in polymers. Market trends indicate growing interest in its application as a precursor in advanced chemical synthesis and its role in developing new chemical products.

How should waste containing (2R,3S)-2-{(1R)-1-[3,5-Bis(trifluoromethyl)phenyl]ethoxy}-3-(4-fluorophenyl)morpholine 4-methylbenzenesulfonate (1:1) (CAS: 200000-59-5) be handled?

Waste containing this compound (CAS: 200000-59-5) should be collected in appropriate containers and disposed of through professional waste disposal services. Incineration under controlled conditions or chemical-neutralization methods are recommended for safe disposal, ensuring compliance with environmental protection regulations.

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(2R,3S)-2-{(1R)-1-[3,5-Bis(trifluoromethyl)phenyl]ethoxy}-3-(4-fluorophenyl)morpholine 4-methylbenzenesulfonate (1:1) | CAS No. 200000-59-5

Basic Information

CAS Number

Molecular Formula

Molecular Weight

Chemical Classification

Basic Physical Properties

Chemical Properties

SMILES

InChI

InChIKey

LogP

Topological Polar Surface Area

Hydrogen Bond Donor/Acceptor

Complexity

Safety Information

Hazard Statement

Synonyms & References

English

MDL Number

FAQ

What regulatory guidelines apply to (2R,3S)-2-{(1R)-1-[3,5-Bis(trifluoromethyl)phenyl]ethoxy}-3-(4-fluorophenyl)morpholine 4-methylbenzenesulfonate (1:1) (CAS: 200000-59-5)?

Are there alternatives to (2R,3S)-2-{(1R)-1-[3,5-Bis(trifluoromethyl)phenyl]ethoxy}-3-(4-fluorophenyl)morpholine 4-methylbenzenesulfonate (1:1) (CAS: 200000-59-5) in synthesis?

What is the market or research trend for (2R,3S)-2-{(1R)-1-[3,5-Bis(trifluoromethyl)phenyl]ethoxy}-3-(4-fluorophenyl)morpholine 4-methylbenzenesulfonate (1:1) (CAS: 200000-59-5)?

How should waste containing (2R,3S)-2-{(1R)-1-[3,5-Bis(trifluoromethyl)phenyl]ethoxy}-3-(4-fluorophenyl)morpholine 4-methylbenzenesulfonate (1:1) (CAS: 200000-59-5) be handled?

Related Compounds

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