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625-06-9

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625-06-9 Structure

625-06-9 Structure
IdentificationBack Directory
[Name]

2,4-DIMETHYL-2-PENTANOL
[CAS]

625-06-9
[Synonyms]

2,4-DIMETHYL-2-PENTANOL
2,4-dimethyl-pentan-2-ol
Dimethylisobutylcarbinol
Isobutyldimethylcarbinol
1,1,3-Trimethyl-1-butanol
[EINECS(EC#)]

210-877-3
[Molecular Formula]

C7H16O
[MDL Number]

MFCD00021811
[MOL File]

625-06-9.mol
[Molecular Weight]

116.2
Chemical PropertiesBack Directory
[Melting point ]

-30.45°C (estimate)
[Boiling point ]

132-134°C
[density ]

0,81 g/cm3
[refractive index ]

1.4170
[Fp ]

38°C
[pka]

15.38±0.29(Predicted)
[Water Solubility ]

13.22g/L(25 ºC)
[BRN ]

1731623
Safety DataBack Directory
[Risk Statements ]

10
[Safety Statements ]

23-24/25
[RIDADR ]

1987
[HazardClass ]

3
[PackingGroup ]

III
Hazard InformationBack Directory
[Uses]

2,4-Dimethyl-2-pentanol is used in the development of two reliable aqueous solubility models ASMS (aq. soly. based on mol. surface) and ASMS-?LOGP (aq. soly. based on mol. surface using calcd. log P (ClogP).
Spectrum DetailBack Directory
[Spectrum Detail]

2,4-DIMETHYL-2-PENTANOL(625-06-9)MS
2,4-DIMETHYL-2-PENTANOL(625-06-9)1HNMR
2,4-DIMETHYL-2-PENTANOL(625-06-9)13CNMR
2,4-DIMETHYL-2-PENTANOL(625-06-9)IR1
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