2-[(1R)-3-(Diisopropylamino)-1-phenylpropyl]-4-(hydroxymethyl)phenyl 2-methylpropanoate (2E)-2-butenedioate (1:1)

Basic Information

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CAS Number

286930-03-8

Molecular Formula

C30H41NO7

Molecular Weight

527.66 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

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

Melting Point

72-78°C

SMILES

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CC(C)C(=O)OC1=C(C=C(C=C1)CO)C(CCN(C(C)C)C(C)C)C2=CC=CC=C2.C(=CC(=O)O)C(=O)O

InChI

InChI=1S/C26H37NO3.C4H4O4/c1-18(2)26(29)30-25-13-12-21(17-28)16-24(25)23(22-10-8-7-9-11-22)14-15-27(19(3)4)20(5)6;5-3(6)1-2-4(7)8/h7-13,16,18-20,23,28H,14-15,17H2,1-6H3;1-2H,(H,5,6)(H,7,8)/b;2-1+/t23-;/m1./s1

InChIKey

MWHXMIASLKXGBU-RNCYCKTQSA-N

LogP

5.092900000000005

Topological Polar Surface Area

124.37000000000002 Å²

Hydrogen Bond Donor/Acceptor

3 / 8

Complexity

610

Synonyms & References

English

Fesoterodine fumarate
SCHEMBL814971
2-((1R)-3-(bis(1-methylethyl)amino)-1-phenylpropyl)-4-(hydroxymethyl)phenyl 2-methylpropanoate hydrogen (2E)-butenedioate (salt)
D08923
2-((1R)-3-(BIS(1-METHYLETHYL)AMINO)-1-PHENYLPROPYL)-4-(HYDROXYMETHYL)PHENYL 2-METHYLPROPANOATE HYDROGEN(2E)-BUTENEDIOATE (SALT)
Fesoterodine fumarate (JAN/USAN)
286930-03-8
AKOS005146248
SCHEMBL1993632
FESOTERODINE FUMARATE [JAN]
KS-1298
BCP9000682
SPM 8272
SPM 907
Fesoterodine (fumarate)
SMR002544691
UNII-EOS72165S7
MLS003915638
AKOS015855886
FESOTERODINE FUMARATE [EMA EPAR]
PROPANOIC ACID,2-METHYL ,2-((1R)-3-(BIS(1-METHYLETHYL)AMINO)-1-PHENYLPROPYL)-4-(HYDROXYMETHYL)PHENYL ESTER,(2E)-2-BUTENEDIOATE (1:1)(SALT)
FESOTERODINE FUMARATE [VANDF]
Fesoterodine maleate
AC-3486
FESOTERODINE FUMARATE [MI]
CHEMBL1201765
(E)-but-2-enedioic acid;[2-[(1R)-3-[di(propan-2-yl)amino]-1-phenylpropyl]-4-(hydroxymethyl)phenyl] 2-methylpropanoate
(R)-Fesoterodinefumarate
BCPP000231
286930-03-8 (fumarate); 286930-02-7 (free base)
EOS72165S7

MDL Number

MFCD12756004

FAQ

What regulatory guidelines apply to 2-[(1R)-3-(Diisopropylamino)-1-phenylpropyl]-4-(hydroxymethyl)phenyl 2-methylpropanoate (2E)-2-butenedioate (1:1) (CAS: 286930-03-8)?

This compound falls under the EU's REACH regulations for chemical substances. It must comply with GHS (Globally Harmonized System of Classification and Labelling of Chemicals) for hazard communication. FDA and EPA regulations also apply for its use in the US, particularly concerning its classification and labeling requirements. Additionally, it should follow local and international environmental protection laws.

Are there alternatives to 2-[(1R)-3-(Diisopropylamino)-1-phenylpropyl]-4-(hydroxymethyl)phenyl 2-methylpropanoate (2E)-2-butenedioate (1:1) (CAS: 286930-03-8) in synthesis?

For synthesis alternatives, one could consider using isomers or analogs of the compound. Common substitutes include diisopropylamine derivatives and other phenolic compounds with similar functional groups. These alternatives can provide similar reactivity but with different physical and chemical properties, which may be more suitable for specific applications.

What is the market or research trend for 2-[(1R)-3-(Diisopropylamino)-1-phenylpropyl]-4-(hydroxymethyl)phenyl 2-methylpropanoate (2E)-2-butenedioate (1:1) (CAS: 286930-03-8)?

The compound has seen growing interest in research due to its unique molecular structure, which offers potential in pharmaceuticals and materials science. Market trends indicate increasing demand for this compound in developing new drugs and functional materials. Emerging research focuses on its bioavailability, toxicity, and potential therapeutic applications.

How should waste containing 2-[(1R)-3-(Diisopropylamino)-1-phenylpropyl]-4-(hydroxymethyl)phenyl 2-methylpropanoate (2E)-2-butenedioate (1:1) (CAS: 286930-03-8) be handled?

Waste containing this compound should be collected in appropriate containers and stored separately. For disposal, it is advisable to incinerate the waste in an environmentally controlled incinerator. Alternatively, professional waste disposal services can manage the waste, ensuring compliance with local environmental regulations. Always follow safe handling and disposal protocols to prevent environmental contamination.

Related Compounds

N-[(3S)-1-(Dimethylcarbamoyl)-3-pyrrolidinyl]-5-[(Z)-(5-fluoro-2-oxo-1,2-dihydro-3H-indol-3-ylidene)methyl]-2,4-dimethyl-1H-pyrrole-3-carboxamide

CAS Number: 1013920-15-4

Molecular Formula: C23H26FN5O3

7-Methylpyrazolo[1,5-a]pyrimidine-3-carboxylic acid structure

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Compound Q&A

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2-[(1R)-3-(Diisopropylamino)-1-phenylpropyl]-4-(hydroxymethyl)phenyl 2-methylpropanoate (2E)-2-butenedioate (1:1) | CAS No. 286930-03-8

Basic Information

CAS Number

Molecular Formula

Molecular Weight

Chemical Classification

Basic Physical Properties

Melting Point

Chemical Properties

SMILES

InChI

InChIKey

LogP

Topological Polar Surface Area

Hydrogen Bond Donor/Acceptor

Complexity

Synonyms & References

English

MDL Number

FAQ

What regulatory guidelines apply to 2-[(1R)-3-(Diisopropylamino)-1-phenylpropyl]-4-(hydroxymethyl)phenyl 2-methylpropanoate (2E)-2-butenedioate (1:1) (CAS: 286930-03-8)?

Are there alternatives to 2-[(1R)-3-(Diisopropylamino)-1-phenylpropyl]-4-(hydroxymethyl)phenyl 2-methylpropanoate (2E)-2-butenedioate (1:1) (CAS: 286930-03-8) in synthesis?

What is the market or research trend for 2-[(1R)-3-(Diisopropylamino)-1-phenylpropyl]-4-(hydroxymethyl)phenyl 2-methylpropanoate (2E)-2-butenedioate (1:1) (CAS: 286930-03-8)?

How should waste containing 2-[(1R)-3-(Diisopropylamino)-1-phenylpropyl]-4-(hydroxymethyl)phenyl 2-methylpropanoate (2E)-2-butenedioate (1:1) (CAS: 286930-03-8) be handled?

Related Compounds

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