ChemicalBook--->CAS DataBase List--->533-87-9

533-87-9

533-87-9 Structure

533-87-9 Structure
IdentificationMore
[Name]

ALEURITIC ACID
[CAS]

533-87-9
[Synonyms]

9,10,16-TRIHYDROXYHEXADECANOIC ACID
9,10,16-TRIHYDROXYPALMITIC ACID
ALEURITIC ACID
DL-ERYTHRO-9,10,16-TRIHYDROXYPALMITIC ACID
DL-THREO-9,10,16-TRIHYDROXYPALMITIC ACID
ERYTHRO-8,9,15-TRIHYDROXYPENTADECANE-1-CARBOXYLIC ACID
ERYTHRO-9,10,16-TRIHYDROXYPALMITIC ACID
ERYTHRO-ALEURITIC ACID
ERYTHRO-TRIHYDROXYHEXADECANOIC ACID
10,16-trihydroxy-erythro-dl-hexadecanoicaci
8,9,15-Trihydroxypalmitic acid
8,9,15-Trihydroxypentadecane-1-carboxylic acid
8,9,15-trihydroxypentadecane-1-carboxylicacid
9,10,16-trihydroxy-,(r*,s*)-(+-)-hexadecanoicaci
9,10,16-trihydroxy-,(R*,S*)-(±)-Hexadecanoicacid
9,10,16-trihydroxy-,(theta,s)-(+/-)-hexadecanoicaci
aleuriticacid,tech.
alpha-aleuriticacid
DL-erythro-9,10,16-Trihydroxyhexadecanoic acid
dl-erythro-9,10,16-trihydroxyhexadecanoicacid
[EINECS(EC#)]

232-692-7
[Molecular Formula]

C16H32O5
[MDL Number]

MFCD00135596
[Molecular Weight]

304.42
[MOL File]

533-87-9.mol
Chemical PropertiesBack Directory
[Appearance]

white to beige crystalline powder
[Melting point ]

100-101 °C(lit.)
[Boiling point ]

365.24°C (rough estimate)
[density ]

1.085
[refractive index ]

1.6200 (estimate)
[storage temp. ]

Sealed in dry,Room Temperature
[solubility ]

Chloroform (Slightly, Heated), DMSO (Slightly), Ethyl Acetate (Slightly, Heated)
[form ]

Crystalline Powder
[pka]

4.78±0.10(Predicted)
[color ]

White to beige
[Water Solubility ]

Soluble in water, alcohol, acetic acid and acetone.
[Merck ]

14,231
[BRN ]

1727724
[Stability:]

Hygroscopic
[Major Application]

pharmaceutical small molecule
[InChI]

1S/C16H32O5/c17-13-9-5-4-7-11-15(19)14(18)10-6-2-1-3-8-12-16(20)21/h14-15,17-19H,1-13H2,(H,20,21)/t14-,15+/m1/s1
[InChIKey]

MEHUJCGAYMDLEL-CABCVRRESA-N
[SMILES]

OCCCCCC[C@H](O)[C@H](O)CCCCCCCC(O)=O
[LogP]

2.830
[CAS DataBase Reference]

533-87-9(CAS DataBase Reference)
[EPA Substance Registry System]

.alpha.-Aleuritic acid (533-87-9)
Safety DataBack Directory
[Symbol(GHS) ]


GHS07
[Signal word ]

Warning
[Hazard statements ]

H302-H315-H319-H335
[Precautionary statements ]

P261-P301+P312-P302+P352-P304+P340-P305+P351+P338
[Safety Statements ]

S22:Do not breathe dust .
S24/25:Avoid contact with skin and eyes .
[WGK Germany ]

3
[RTECS ]

ML9850000
[TSCA ]

Yes
[HS Code ]

29181998
[Storage Class]

11 - Combustible Solids
Hazard InformationBack Directory
[Chemical Properties]

white to beige crystalline powder
[Uses]

α-Aleuritic acid is a major ingredient of shellac and is also a starting reagent in the manufacture of perfumes.
[Purification Methods]

Crystallise the acid from aqueous EtOH. The hydrazide crystallises from EtOH and has m 139-140o. [Beilstein 3 III 901.]
Spectrum DetailBack Directory
[Spectrum Detail]

ALEURITIC ACID(533-87-9)MS
ALEURITIC ACID(533-87-9)1HNMR
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

('±)-erythro-Aleuritic acid, 95%(533-87-9)
[Alfa Aesar]

(+/-)-erythro-Aleuritic acid, 95%(533-87-9)
[Sigma Aldrich]

533-87-9(sigmaaldrich)
[TCI AMERICA]

erythro-Aleuritic Acid,>95.0%(T)(533-87-9)
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