ChemicalBook--->CAS DataBase List--->5779-94-2

5779-94-2

5779-94-2 Structure

5779-94-2 Structure
IdentificationMore
[Name]

2,5-Dimethylbenzaldehyde
[CAS]

5779-94-2
[Synonyms]

2,5-DIMETHYLBENZALDEHYDE
25 DMB
TIMTEC-BB SBB008435
Isoxylaldehyde
2,5-DIMETHYLBENZALDEHYDE 99%
[EINECS(EC#)]

227-303-2
[Molecular Formula]

C9H10O
[MDL Number]

MFCD00003342
[Molecular Weight]

134.18
[MOL File]

5779-94-2.mol
Chemical PropertiesBack Directory
[Appearance]

CLEAR COLORLESS TO VERY SLIGHTLY YELLOW LIQUID
[Boiling point ]

104.5-106.5 °C/14 mmHg (lit.)
[density ]

0.95 g/mL at 25 °C(lit.)
[refractive index ]

n20/D 1.544(lit.)
[Fp ]

190 °F
[storage temp. ]

under inert gas (nitrogen or Argon) at 2-8°C
[solubility ]

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

Oil
[color ]

Colourless
[Specific Gravity]

0.95
[Water Solubility ]

Not miscible in water.
[Sensitive ]

Air Sensitive
[BRN ]

1927303
[InChI]

1S/C9H10O/c1-7-3-4-8(2)9(5-7)6-10/h3-6H,1-2H3
[InChIKey]

SMUVABOERCFKRW-UHFFFAOYSA-N
[SMILES]

Cc1ccc(C)c(C=O)c1
[LogP]

2.560 (est)
[CAS DataBase Reference]

5779-94-2(CAS DataBase Reference)
[NIST Chemistry Reference]

Benzaldehyde, 2,5-dimethyl-(5779-94-2)
[EPA Substance Registry System]

5779-94-2(EPA Substance)
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H227
[Precautionary statements ]

P210e-P280a-P370+P378a-P403+P235-P501a
[Safety Statements ]

S24/25:Avoid contact with skin and eyes .
[WGK Germany ]

3
[HS Code ]

29122990
[Storage Class]

10 - Combustible liquids
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

2,5-Dimethylbenzaldehyde(5779-94-2).msds
Hazard InformationBack Directory
[Chemical Properties]

CLEAR COLORLESS TO VERY SLIGHTLY YELLOW LIQUID
[Uses]

2,5-Dimethylbenzaldehyde is useful for building asymmetric top molecules. 2,5-DMBA has also been used to analyze vehicle carbon emissions.
[Definition]

ChEBI: 2,5-Dimethylbenzaldehyde is a carbonyl compound.
[General Description]

The LD vehicle′s emmision factor for 2,5-dimethylbenzaldehyde was studied.
[Toxics Screening Level]

The CAS and NLM on-line literature searches for this evaluation were conducted on June 16, 2009. No toxicity information could be located for 2,5-dimethylbenzaldehyde. Due to a lack of data the screening level is being set at the default of 0.1μg/m3 with annual averaging under R232 (1) (i).
Spectrum DetailBack Directory
[Spectrum Detail]

2,5-Dimethylbenzaldehyde(5779-94-2)MS
2,5-Dimethylbenzaldehyde(5779-94-2)1HNMR
2,5-Dimethylbenzaldehyde(5779-94-2)13CNMR
2,5-Dimethylbenzaldehyde(5779-94-2)IR1
2,5-Dimethylbenzaldehyde(5779-94-2)Raman
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

2,5-Dimethylbenzaldehyde, 95%(5779-94-2)
[Alfa Aesar]

2,5-Dimethylbenzaldehyde, 98%(5779-94-2)
[Sigma Aldrich]

5779-94-2(sigmaaldrich)
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