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5875-45-6

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5875-45-6 Structure

5875-45-6 Structure
IdentificationBack Directory
[Name]

2,5-DI-TERT-BUTYLPHENOL
[CAS]

5875-45-6
[Synonyms]

Nsc 68767
Einecs 227-543-8
DI-TERT-BUTYLPHENOL
2,5-DI-TERT-BUTYLPHENOL
Phenol, 2,5-di-tert-butyl-
Phenol, 2,5-di-tert-butyl- (8ci)
2,5-bis(1,1-dimethylethyl)-pheno
2,5-bis(1,1-dimethylethyl)-Phenol
Phenol, 2,5-bis(1,1-dimethylethyl
[EINECS(EC#)]

227-543-8
[Molecular Formula]

C14H22O
[MDL Number]

MFCD00233163
[MOL File]

5875-45-6.mol
[Molecular Weight]

206.32
Chemical PropertiesBack Directory
[Melting point ]

141.1-142.2 °C
[Boiling point ]

283.4±9.0 °C(Predicted)
[density ]

0.932±0.06 g/cm3(Predicted)
[pka]

11.46±0.10(Predicted)
[InChI]

InChI=1S/C14H22O/c1-13(2,3)10-7-8-11(12(15)9-10)14(4,5)6/h7-9,15H,1-6H3
[InChIKey]

KDBZVULQVCUNNA-UHFFFAOYSA-N
[SMILES]

C1(O)=CC(C(C)(C)C)=CC=C1C(C)(C)C
[EPA Substance Registry System]

Phenol, 2,5-bis(1,1-dimethylethyl)- (5875-45-6)
Safety DataBack Directory
[Symbol(GHS) ]

GHS hazard pictograms
GHS07
[Signal word ]

Warning
[Hazard statements ]

H315-H413-H335-H319
[Precautionary statements ]

P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362
[RIDADR ]

3077
[TSCA ]

TSCA listed
[HazardClass ]

9
[PackingGroup ]

III
Hazard InformationBack Directory
[Definition]

ChEBI: 2,5-di-tert-butylphenol is a member of the class of phenols that is phenol substituted by tert-butyl groups at position 2 and 5. It has a role as a plant metabolite and a mammalian metabolite. It is a member of phenols and an alkylbenzene.
Spectrum DetailBack Directory
[Spectrum Detail]

2,5-DI-TERT-BUTYLPHENOL(5875-45-6)MS
2,5-DI-TERT-BUTYLPHENOL(5875-45-6)IR1
2,5-DI-TERT-BUTYLPHENOL(5875-45-6)IR2
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