ChemicalBook--->CAS DataBase List--->10042-59-8

10042-59-8

10042-59-8 Structure

10042-59-8 Structure
IdentificationBack Directory
[Name]

2-PROPYL-1-HEPTANOL
[CAS]

10042-59-8
[Synonyms]

2-propylheptanol
2-propyl-1-heptano
2-PROPYL-1-HEPTANOL
2-PROPYLHEPTAN-1-OL
1-Heptanol, 2-propyl-
2-n-Propyl-1-heptanol
2-Propylheptyl Alcohol
[EINECS(EC#)]

233-126-1
[Molecular Formula]

C10H22O
[MDL Number]

MFCD00046768
[MOL File]

10042-59-8.mol
[Molecular Weight]

158.28
Chemical PropertiesBack Directory
[Melting point ]

-1.53°C (estimate)
[Boiling point ]

213.4°C (estimate)
[density ]

0.8280
[vapor pressure ]

2Pa at 25℃
[refractive index ]

1.4360
[storage temp. ]

Sealed in dry,Room Temperature
[solubility ]

Chloroform (Slightly), Ethyl Acetate (Slightly), Methanol (Slightly)
[form ]

Oil
[pka]

15.09±0.10(Predicted)
[color ]

Colourless
[Water Solubility ]

Insoluble in water. Miscible with most common organic solvents.
[Henry's Law Constant]

3.3×10-2 mol/(m3Pa) at 25℃, Yaws (2003)
[InChI]

InChI=1S/C10H22O/c1-3-5-6-8-10(9-11)7-4-2/h10-11H,3-9H2,1-2H3
[InChIKey]

YLQLIQIAXYRMDL-UHFFFAOYSA-N
[SMILES]

C(O)C(CCC)CCCCC
[LogP]

4.1 at 20℃
[EPA Substance Registry System]

1-Heptanol, 2-propyl- (10042-59-8)
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H315-H319-H335
[Precautionary statements ]

P261-P280a-P304+P340-P305+P351+P338-P405-P501a
[RTECS ]

MJ4800000
[TSCA ]

Yes
[REACH Registrations]

Active
Hazard InformationBack Directory
[Chemical Properties]

Light Yellow Oil
[Uses]

2-Propyl-1-heptanol (cas# 10042-59-8) is a compound useful in organic synthesis.
[Application]

2-propylheptanol is a branched C10 fatty alcohol. Mainly used as plasticizer alcohol (phthalic anhydride, trimellitic anhydride and adipic acid), and as raw material for making surfactants used in detergents or in industrial cleaning agents for hard surface cleaning. It is also used as raw material for lubricants and acrylates in adhesives applications.
[Preparation]

2-Propyl Heptanol (2-PH) is the precursor to Di-propylheptylphthalate (DPHP): a similar component to Di-ethylhexylphthalate (DEHP) and Di-octyl-phtalate (DOP) which is made from 2-Ethyl Hexanol (2-EH). It is produced from the hydroformylation ("oxo synthesis") of C4 alkenes followed by hydrogenation of the resulting aldehyde. The production route is similar to that for 2-Ethylhexanol.
[Synthesis Reference(s)]

The Journal of Organic Chemistry, 15, p. 54, 1950 DOI: 10.1021/jo01147a010
[Flammability and Explosibility]

Nonflammable
[storage]

Store at -20°C
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