ChemicalBook--->CAS DataBase List--->61931-68-8

61931-68-8

61931-68-8 Structure

61931-68-8 Structure
IdentificationMore
[Name]

2-Methyl-5-phenylbenzoxazole
[CAS]

61931-68-8
[Synonyms]

2-METHYL-5-PHENYL-1,3-BENZOXAZOLE
2-METHYL-5-PHENYLBENZOXAZOLE
AKOS BBS-00006341
2-methyl-5-phenyl-benzoxazol
2-Methyl-5-phenybenzoxazole
5-Phenyl-2-methylbenzoxazole
[EINECS(EC#)]

263-330-6
[Molecular Formula]

C14H11NO
[MDL Number]

MFCD00005772
[Molecular Weight]

209.24
[MOL File]

61931-68-8.mol
Chemical PropertiesBack Directory
[Appearance]

BEIGE FINE CRYSTALLINE POWDER
[Melting point ]

60-64 °C(lit.)
[Boiling point ]

158 °C / 2mmHg
[density ]

1.0966 (rough estimate)
[refractive index ]

1.5780 (estimate)
[storage temp. ]

Sealed in dry,Room Temperature
[form ]

powder to crystal
[pka]

1.49±0.10(Predicted)
[color ]

White to Light yellow to Light orange
[BRN ]

159076
[InChI]

1S/C14H11NO/c1-10-15-13-9-12(7-8-14(13)16-10)11-5-3-2-4-6-11/h2-9H,1H3
[InChIKey]

CHZDPBVCBBQQRP-UHFFFAOYSA-N
[SMILES]

Cc1nc2cc(ccc2o1)-c3ccccc3
[LogP]

3.544 (est)
[CAS DataBase Reference]

61931-68-8(CAS DataBase Reference)
[EPA Substance Registry System]

61931-68-8(EPA Substance)
Safety DataBack Directory
[Symbol(GHS) ]

Skull and Crossbones (GHS06)
GHS06
[Signal word ]

Danger
[Hazard statements ]

H301-H315-H319-H335
[Precautionary statements ]

P301+P310+P330-P302+P352-P305+P351+P338
[Hazard Codes ]

Xi
[Risk Statements ]

R36/37/38:Irritating to eyes, respiratory system and skin .
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36:Wear suitable protective clothing .
[RIDADR ]

2811
[WGK Germany ]

3
[RTECS ]

DM4865170
[TSCA ]

TSCA listed
[HazardClass ]

6.1(b)
[PackingGroup ]

III
[HS Code ]

29349990
[Storage Class]

6.1C - Combustible acute toxic Cat.3
toxic compounds or compounds which causing chronic effects
[Hazard Classifications]

Acute Tox. 3 Oral
Eye Irrit. 2
Skin Irrit. 2
STOT SE 3
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

2-Methyl-5-phenylbenzoxazole(61931-68-8).msds
Hazard InformationBack Directory
[Chemical Properties]

BEIGE FINE CRYSTALLINE POWDER
[Uses]

2-Methyl-5-phenylbenzoxazole was used in the preparation of 2-methyl-3-ethyl-5-phenyl-1H-benzoxazolium iodide (QM1).
Spectrum DetailBack Directory
[Spectrum Detail]

2-Methyl-5-phenylbenzoxazole(61931-68-8)1HNMR
2-Methyl-5-phenylbenzoxazole(61931-68-8)13CNMR
2-Methyl-5-phenylbenzoxazole(61931-68-8)IR
2-Methyl-5-phenylbenzoxazole(61931-68-8)Raman
Well-known Reagent Company Product InformationBack Directory
[Sigma Aldrich]

61931-68-8(sigmaaldrich)
[TCI AMERICA]

2-Methyl-5-phenylbenzoxazole,>95.0%(T)(61931-68-8)
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