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20850-49-1

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20850-49-1 Structure

20850-49-1 Structure
IdentificationMore
[Name]

3-Methyl-2-(3,4-dimethoxyphenyl)butyronitrile
[CAS]

20850-49-1
[Synonyms]

2-(3,4-DIMETHOXY PHENYL)-3-METHYLBUTYRONITRILE
2-(3,4-DIMETHOXY PHENYL)-ALPHA-METHYLBUTYRONITRILE
3-METHYL-2-(3,4-DIMETHOXYPHENYL)BUTYRONITRILE
BENZENEACETONITRILE, 3,4-DIMETHOXY-ALPHA-(1-METHYLETHYL)-
alpha-Isopropyl homoveratronitrile
2-(3,4-Dimethoxy Pheny)-3-Methylbutyronitrile
3,4-Dimethoxy-Alpha-(1-Methylethyl)Benzene Acetonitrile
3,4-Dimethoxy-α-(1-methylethyl)benzeneacetonitrile
a-Isopropylhomoveratronitrile
3,4-Dimethoxy-alpha-(1-Methylethyl)benzonitrile
(-2-(3,4-Dimethoxyphenyl)-3-methylbutanenitrile
3,4-Dimethoxy-a-(1-methylethyl)benzeneacetonitrile
3,4-Dimethoxy-a-(1-methylethyl)-benzeneacetonitrile
2-(3,4-DIMETHOXY PHENYL)-SS-METHYLBUTYRONITRILE
α-(3,4-Dimethoxyphenyl)isovaleronitrile
2-(3,4-Dimethoxyphenyl)-2-isopropylacetonitrile
BENZENEACETONITRILE,3,4-DIMETHOXY-A-(1-METHYLETHYL)-
α-Isopropyl-3,4-dimethoxybenzeneacetonitrile
[EINECS(EC#)]

244-082-8
[Molecular Formula]

C13H17NO2
[MDL Number]

MFCD00800230
[Molecular Weight]

219.28
[MOL File]

20850-49-1.mol
Chemical PropertiesBack Directory
[Melting point ]

46-49°C
[Boiling point ]

160-166 °C(Press: 6 Torr)
[density ]

1.023±0.06 g/cm3(Predicted)
[storage temp. ]

Sealed in dry,Room Temperature
[solubility ]

Chloroform (Slightly), Methanol (Slightly)
[form ]

Solid
[color ]

White to Pale Yellow
[Major Application]

pharmaceutical
[InChI]

1S/C13H17NO2/c1-9(2)11(8-14)10-5-6-12(15-3)13(7-10)16-4/h5-7,9,11H,1-4H3
[InChIKey]

NFXAXMOAVPLEBH-UHFFFAOYSA-N
[SMILES]

N#CC(C(C)C)c1cc(c(cc1)OC)OC
[CAS DataBase Reference]

20850-49-1(CAS DataBase Reference)
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H315-H319-H335
[Precautionary statements ]

P280-P304+P340-P305+P351+P338
[WGK Germany ]

WGK 3
[REACH Registrations]

Active
[HazardClass ]

IRRITANT
[HS Code ]

2926907090
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Acute Tox. 4 Oral
Raw materials And Preparation ProductsBack Directory
[Raw materials]

Dimethyl sulfate-->Sodium cyanide-->Benzeneacetonitrile-->2-Bromopropane-->Guaiacol-->1,2-Dimethoxybenzene-->3,4-Dimethoxybenzyl chloride
Hazard InformationBack Directory
[Chemical Properties]

Pale Yellow Solid
[Uses]

(Verapamil EP Impurity K)
Spectrum DetailBack Directory
[Spectrum Detail]

3-Methyl-2-(3,4-dimethoxyphenyl)butyronitrile(20850-49-1)1HNMR
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