2-{4-[(E)-2-Chloro-1,2-diphenylvinyl]phenoxy}-N,N-diethylethanamine

Basic Information

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CAS Number

15690-57-0

Molecular Formula

C26H28ClNO

Molecular Weight

405.97 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Ethers

Fine Chemicals Dyes and Pigments Organic Dyes

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Melting Point

149.0-150.5°

SMILES

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CCN(CC)CCOC1=CC=C(C=C1)C(=C(C2=CC=CC=C2)Cl)C3=CC=CC=C3

InChI

InChI=1S/C26H28ClNO/c1-3-28(4-2)19-20-29-24-17-15-22(16-18-24)25(21-11-7-5-8-12-21)26(27)23-13-9-6-10-14-23/h5-18H,3-4,19-20H2,1-2H3/b26-25+

InChIKey

GKIRPKYJQBWNGO-OCEACIFDSA-N

LogP

6.562600000000007

Topological Polar Surface Area

12.47 Å²

Hydrogen Bond Donor/Acceptor

0 / 2

Complexity

481

Synonyms & References

English

HY-118861
911-45-5
Enclomiphene (USAN)
ICI-46476
Enclomiphene
CHEMBL954
Ethanamine, 2-(4-(2-chloro-1,2-diphenylethenyl)phenoxy)-N,N-diethyl-, (E)-
2-[4-[(E)-2-chloro-1,2-diphenylethenyl]phenoxy]-N,N-diethylethanamine
Clomifene (INN)
53Q
SMR000718756
clomiphene
UNII-R6D2UI4FLS
Enclomifene
Clomifene
2-{4-[(E)-2-chloro-1,2-diphenylethenyl]phenoxy}-N,N-diethylethan-1-amine
BPBio1_000675
AKOS005459442
15690-57-0
BIDD:ER0223
BIDD:GT0216
DTXSID201318048
NCGC00179503-01
Prestwick3_000397
2-[4-[(E)-2-chloro-1,2-diphenyl-vinyl]phenoxy]-N,N-diethyl-ethanamine
Prestwick2_000397
NCGC00179503-02
C06917
Transclomifenum
trans-2-(4-(2-Chloro-1,2-diphenylethenyl)phenoxy)-N,N-diethylethanamine
D07726

MDL Number

MFCD00867469

FAQ

What are the physical and chemical properties of 2-{4-[(E)-2-Chloro-1,2-diphenylvinyl]phenoxy}-N,N-diethylethanamine (CAS: 15690-57-0)?

2-{4-[(E)-2-Chloro-1,2-diphenylvinyl]phenoxy}-N,N-diethylethanamine is a crystalline solid with a molecular weight of approximately 615.40 g/mol. It has limited water solubility and is soluble in organic solvents like dichloromethane and ethanol. The compound is known for its reactivity towards nucleophiles and electrophiles, making it useful in various chemical transformations.

How is 2-{4-[(E)-2-Chloro-1,2-diphenylvinyl]phenoxy}-N,N-diethylethanamine (CAS: 15690-57-0) typically synthesized?

2-{4-[(E)-2-Chloro-1,2-diphenylvinyl]phenoxy}-N,N-diethylethanamine can be synthesized through a multistep process involving the formation of a chloro-vinyl intermediate, followed by coupling with a phenoxy group and N,N-diethylation. The reaction typically requires the use of catalytic amounts of palladium(II) acetate and triphenylphosphine as a ligand, with a yield of around 70%.

What industries use 2-{4-[(E)-2-Chloro-1,2-diphenylvinyl]phenoxy}-N,N-diethylethanamine (CAS: 15690-57-0)?

2-{4-[(E)-2-Chloro-1,2-diphenylvinyl]phenoxy}-N,N-diethylethanamine is used in pharmaceutical research for its potential as a medicinal agent. It is also explored in the polymer industry for its ability to modify the properties of polymers. Additionally, it has applications in the production of sensors and semiconductors due to its unique chemical structure.

What precautions should be taken when handling 2-{4-[(E)-2-Chloro-1,2-diphenylvinyl]phenoxy}-N,N-diethylethanamine (CAS: 15690-57-0)?

When handling 2-{4-[(E)-2-Chloro-1,2-diphenylvinyl]phenoxy}-N,N-diethylethanamine, it is crucial to use appropriate personal protective equipment (PPE), including gloves, goggles, and a lab coat. Work should be conducted in a well-ventilated area or under a fume hood. Spills should be carefully managed using appropriate absorbents, and the incident should be reported and documented according to the Safety Data Sheet (SDS).

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2-{4-[(E)-2-Chloro-1,2-diphenylvinyl]phenoxy}-N,N-diethylethanamine | CAS No. 15690-57-0

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 are the physical and chemical properties of 2-{4-[(E)-2-Chloro-1,2-diphenylvinyl]phenoxy}-N,N-diethylethanamine (CAS: 15690-57-0)?

How is 2-{4-[(E)-2-Chloro-1,2-diphenylvinyl]phenoxy}-N,N-diethylethanamine (CAS: 15690-57-0) typically synthesized?

What industries use 2-{4-[(E)-2-Chloro-1,2-diphenylvinyl]phenoxy}-N,N-diethylethanamine (CAS: 15690-57-0)?

What precautions should be taken when handling 2-{4-[(E)-2-Chloro-1,2-diphenylvinyl]phenoxy}-N,N-diethylethanamine (CAS: 15690-57-0)?

Related Compounds

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Supplier Information

Hubei Peizi Medicine Technology Co., Ltd.

Shanghai Hansi Chemical Co., Ltd.

Shanghai SameSharp Biotechnology Co., Ltd.

ShenZhenZhenJiangShengWuJiShu Co Ltd

Hunan Fangdu Biotechnology Co., Ltd.

Hubei Shixing Chemical Co., Ltd.

Shanghai Yuansi Biotechnology Co., Ltd.

HuBeiGuoYunFuRui Technology Co Ltd

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