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23617-71-2

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23617-71-2 Structure

23617-71-2 Structure
IdentificationBack Directory
[Name]

methyl 2,4-dimethylbenzoate
[CAS]

23617-71-2
[Synonyms]

methyl 2,4-dimethylbenzoate
2,4-DIMETHYLBENZOIC ACID METHYL ESTER
Benzoic acid, 2,4-dimethyl-, methyl ester
[Molecular Formula]

C10H12O2
[MDL Number]

MFCD06203654
[MOL File]

23617-71-2.mol
[Molecular Weight]

164.2
Chemical PropertiesBack Directory
[Melting point ]

-2°C
[Boiling point ]

232.5°C (estimate)
[density ]

1.0326 (rough estimate)
[refractive index ]

1.5052 (estimate)
[storage temp. ]

Sealed in dry,Room Temperature
[form ]

solid
[Appearance]

Colorless to light yellow Liquid
[InChI]

1S/C10H12O2/c1-7-4-5-9(8(2)6-7)10(11)12-3/h4-6H,1-3H3
[InChIKey]

QQCLNRPRQRDMCK-UHFFFAOYSA-N
[SMILES]

O=C(OC)C1=C(C)C=C(C)C=C1
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H319-H315-H302-H335
[Precautionary statements ]

P264-P280-P305+P351+P338-P337+P313P-P264-P270-P301+P312-P330-P501-P264-P280-P302+P352-P321-P332+P313-P362
[WGK Germany ]

WGK 3
[HS Code ]

2916399090
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Acute Tox. 4 Oral
Hazard InformationBack Directory
[Synthesis Reference(s)]

The Journal of Organic Chemistry, 41, p. 2918, 1976 DOI: 10.1021/jo00879a026
Spectrum DetailBack Directory
[Spectrum Detail]

methyl 2,4-dimethylbenzoate(23617-71-2)1HNMR
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