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ChemicalBook--->CAS DataBase List--->2363-71-5

2363-71-5

2363-71-5 Structure

2363-71-5 Structure
IdentificationMore
[Name]

HENEICOSANOIC ACID
[CAS]

2363-71-5
[Synonyms]

C21:0 FATTY ACID
CARBOXYLIC ACID C21
HENEICOSANOIC ACID
HENICOSANOIC ACID
N-HENEICOSANOIC ACID
N-HENEICOSANOIC ACID 98%
HENEICOSANOIC ACID 99%
Heneicosanoic
[EINECS(EC#)]

219-113-3
[Molecular Formula]

C21H42O2
[MDL Number]

MFCD00002805
[Molecular Weight]

326.56
[MOL File]

2363-71-5.mol
Chemical PropertiesBack Directory
[Appearance]

white shiny fluffy crystalline powder
[Melting point ]

74-75 °C(lit.)
[Boiling point ]

170 °C (0.07501 mmHg)
[density ]

0.8903 (rough estimate)
[refractive index ]

1.4538 (estimate)
[storage temp. ]

2-8°C
[solubility ]

almost transparency in hot Methanol
[form ]

Shiny Fluffy Crystalline Powder
[pka]

4.78±0.10(Predicted)
[color ]

White
[biological source]

plant
[BRN ]

1711889
[InChI]

InChI=1S/C21H42O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21(22)23/h2-20H2,1H3,(H,22,23)
[InChIKey]

CKDDRHZIAZRDBW-UHFFFAOYSA-N
[SMILES]

C(O)(=O)CCCCCCCCCCCCCCCCCCCC
[LogP]

9.810 (est)
[CAS DataBase Reference]

2363-71-5(CAS DataBase Reference)
Safety DataBack Directory
[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 .
[WGK Germany ]

3
[HS Code ]

29159000
Hazard InformationBack Directory
[Hazard]

Combustible.
[Chemical Properties]

white shiny fluffy crystalline powder
[Uses]

Heneicosanoic Acid is a long chain fatty acid used by S.epidermidis for lipopeptide production. In addition, Heneicosanoic Acid can be used as an analytical standard.Environmental contaminants; food contaminants.
[Definition]

ChEBI: A long-chain fatty acid that is henicosane in which one of the methyl groups has been oxidised to give the corresponding carboxylic acid.
Spectrum DetailBack Directory
[Spectrum Detail]

HENEICOSANOIC ACID(2363-71-5)MS
HENEICOSANOIC ACID(2363-71-5)1HNMR
HENEICOSANOIC ACID(2363-71-5)13CNMR
HENEICOSANOIC ACID(2363-71-5)IR1
HENEICOSANOIC ACID(2363-71-5)IR2
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

Heneicosanoic acid, 99%(2363-71-5)
[Sigma Aldrich]

2363-71-5(sigmaaldrich)
[TCI AMERICA]

n-Heneicosanoic Acid,>98.0%(GC)(T)(2363-71-5)
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