3-Buten-2-one, 3-[(4-chlorophenyl)hydroxymethyl]-

Base Information

Chemical Name:3-Buten-2-one, 3-[(4-chlorophenyl)hydroxymethyl]-
CAS No.:170377-13-6
Molecular Formula:C11H11ClO2
Molecular Weight:210.66
Hs Code.:
DSSTox Substance ID:DTXSID10472855
Nikkaji Number:J959.903G

Synonyms:170377-13-6;3-Buten-2-one, 3-[(4-chlorophenyl)hydroxymethyl]-;DTXSID10472855;NCGC00161100-01;NCGC00161100-02;3-((4-chlorophenyl)(hydroxy)methyl)but-3-en-2-one

Suppliers and Price of 3-Buten-2-one, 3-[(4-chlorophenyl)hydroxymethyl]-

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

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Chemical Property of 3-Buten-2-one, 3-[(4-chlorophenyl)hydroxymethyl]-

Chemical Property:

XLogP3:2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:210.0447573
Heavy Atom Count:14
Complexity:229

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(=O)C(=C)C(C1=CC=C(C=C1)Cl)O

Technology Process of 3-Buten-2-one, 3-[(4-chlorophenyl)hydroxymethyl]-

There total 6 articles about 3-Buten-2-one, 3-[(4-chlorophenyl)hydroxymethyl]- which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 95.0%

: 104-88-1
4-chlorobenzaldehyde

: 78-94-4,25038-87-3
methyl vinyl ketone

: 170377-13-6
3-((4-chlorophenyl)(hydroxy)methyl)but-3-en-2-one

Guidance literature:: With 2,6-diphenyl-4H-thiopyran-4-thione; titanium tetrachloride; In dichloromethane; at 0 ℃; for 1h;
DOI:10.1016/S0040-4039(99)00585-7

Reference yield: 87.0%

: 104-88-1
4-chlorobenzaldehyde

: 78-94-4,25038-87-3
methyl vinyl ketone

: 170377-13-6
3-((4-chlorophenyl)(hydroxy)methyl)but-3-en-2-one

: 232944-74-0
(3Z)-3-(chloromethyl)-4-(4-chlorophenyl)but-3-en-2-one

Guidance literature:: 4-chlorobenzaldehyde; methyl vinyl ketone; With 1,9-dibromo-4,6-dihydro-3,5,7-trithiacyclopenta[e]azulene; titanium tetrachloride; In dichloromethane; for 0.25h; Inert atmosphere;

With triethylamine; In dichloromethane; at 20 ℃; for 48h; Inert atmosphere;
DOI:10.1002/cjoc.201400077

Reference yield: 62.0%

: 104-88-1
4-chlorobenzaldehyde

: 78-94-4,25038-87-3
methyl vinyl ketone

: 170377-13-6
3-((4-chlorophenyl)(hydroxy)methyl)but-3-en-2-one

: (R)-3-[(S)-(4-Chloro-phenyl)-hydroxy-methyl]-5-methylene-heptane-2,6-dione

: (S)-3-[(S)-(4-Chloro-phenyl)-hydroxy-methyl]-5-methylene-heptane-2,6-dione

Guidance literature:: With 1,4-diaza-bicyclo[2.2.2]octane; In N,N-dimethyl-formamide; at 20 ℃; for 160h; Title compound not separated from byproducts;
DOI:10.1039/b101019k