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857544-19-5
2-(4-METHOXYPHENYL)-5-METHYL-3-OXOHEXANENITRILE

Directory: 1. Identification; 2. Chemical and Physical Properties; 3. Material Safety Data Sheet(MSDS); 4. CML File; 5. TOP Suppliers; 6. Related products

Name

2-(4-METHOXYPHENYL)-5-METHYL-3-OXOHEXANENITRILE

Formula

C14 H17 N O2

MolWeight

231.293

CCD No.

CCD01113227

CAS

857544-19-5

MDL

MFCD11208674

1Identification

【Name】

2-(4-METHOXYPHENYL)-5-METHYL-3-OXOHEXANENITRILE

【CAS】

857544-19-5

【MDL】

MFCD11208674

【English Synonyms】

4-METHOXY-A-(3-METHYL-1-OXOBUTYL)-BENZENEACETONITRILE

2-(4-METHOXYPHENYL)-5-METHYL-3-OXOHEXANENITRILE

BENZENEACETONITRILE, 4-METHOXY-A-(3-METHYL-1-OXOBUTYL)-

【Formula】

C14 H17 N O2

【MolWeight】

231.293

【Inchi】

InChI=1S/C14H17NO2/c1-10(2)8-14(16)13(9-15)11-4-6-12(17-3)7-5-11/h4-7,10,13H,8H2,1-3H3

【InChIKey】

InChIKey=PHNAECUEBZUNNL-UHFFFAOYSA-N

【SMILES】

CC(C)CC(=O)C(C#N)c1ccc(cc1)OC

【MOL File】

2-(4-METHOXYPHENYL)-….mol

2Chemical and Physical Properties

【Computed Properties】

H bond donor:0

H bond acceptor:3

XLogP3:2.0

Bulk/Fine:F

3Material Safety Data Sheet(MSDS)

4CML File

2-(4-METHOXYPHENYL)-5-METHYL-3-OXOHEXANENITRILE.cml

Quick Release

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857544-19-5 2-(4-METHOXYPHENYL)-5-METHYL-3-OXOHEXANENITRILE

1Identification

【Name】

【CAS】

【MDL】

【English Synonyms】

【Formula】

【MolWeight】

【Inchi】

【InChIKey】

【SMILES】

【MOL File】

2Chemical and Physical Properties

【Computed Properties】

3Material Safety Data Sheet(MSDS)

4CML File

TOP Suppliers

Related products

857544-19-5
2-(4-METHOXYPHENYL)-5-METHYL-3-OXOHEXANENITRILE