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506-12-7

506-12-7 Structure

506-12-7 Structure
IdentificationMore
[Name]

HEPTADECANOIC ACID
[CAS]

506-12-7
[Synonyms]

C17
C17:0 FATTY ACID
CARBOXYLIC ACID C17
HEPTADECANOIC ACID
MARGARIC ACID
N-HEPTADECANOIC ACID
RARECHEM AL BO 0462
1-Heptadecansαure
heptadecanoic
Heptadecansαure
Margarinic acid
margarinicacid
Margarinsαure
n-Heptadecoic acid
n-heptadecoicacid
n-Heptadecylic acid
n-heptadecylicacid
Normal-heptadecanoic acid
Heptadecanoic acide
Heptadecanoicacid,98%
[EINECS(EC#)]

208-027-1
[Molecular Formula]

C17H34O2
[MDL Number]

MFCD00002751
[Molecular Weight]

270.45
[MOL File]

506-12-7.mol
Chemical PropertiesBack Directory
[Appearance]

off-white powder
[Melting point ]

59-61 °C(lit.)
[mp ]

59-61 °C(lit.)
[Boiling point ]

227 °C100 mm Hg(lit.)
[bp ]

227 °C100 mm Hg(lit.)
[density ]

0,853 g/cm3
[refractive index ]

1.4348 (589.3 nm 40℃)
[Fp ]

227°C/100mm
[storage temp. ]

room temp
[form ]

Shiny Flakes or Crystalline Powder
[pka]

4.78±0.10(Predicted)
[color ]

White to off-white
[Stability:]

Stable. Incompatible with bases, oxidizing agents, reducing agents.
[Water Solubility ]

Soluble in ether. Slightly soluble in alcohol. Insoluble in water
[Merck ]

14,5751
[BRN ]

1781004
[InChIKey]

KEMQGTRYUADPNZ-UHFFFAOYSA-N
[CAS DataBase Reference]

506-12-7(CAS DataBase Reference)
[EPA Substance Registry System]

Heptadecanoic acid (506-12-7)
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
[RTECS ]

MI3850000
[TSCA ]

Yes
[HS Code ]

29159000
[Toxicity]

LD50 i.v. in mice: 360.3 mg/kg (Or, Wretlind)
Hazard InformationBack Directory
[Description]

Heptadecanoic acid, or margaric acid, is a saturated fatty acid. Its molecular formula is CH3(CH2)15COOH. It occurs as a trace component of the fat and milkfat of ruminants, but it does not occur in any natural animal or vegetable fat at concentrations over half a percent. Salts and esters of heptadecanoic acid are called heptadecanoates.
[Chemical Properties]

off-white powder
[Uses]

Heptadecanoic acid is a saturated fatty acid and occurs as a trace component of the fat in ruminants.
[Uses]

Margaric acid (Heptadecanoic acid, C17) may be used as a reference during the analysis of medium-chain fatty acids from biomaterials such as seed oils and plant and animal oils.
[Definition]

ChEBI: A C17 saturated fatty acid and trace component of fats in ruminants.
[Synthesis Reference(s)]

Synthetic Communications, 20, p. 3359, 1990 DOI: 10.1080/00397919008051571
[Purification Methods]

Crystallise the acid from MeOH or pet ether. [Beilstein 2 IV 1193.]
Spectrum DetailBack Directory
[Spectrum Detail]

HEPTADECANOIC ACID(506-12-7)MS
HEPTADECANOIC ACID(506-12-7)1HNMR
HEPTADECANOIC ACID(506-12-7)13CNMR
HEPTADECANOIC ACID(506-12-7)IR1
HEPTADECANOIC ACID(506-12-7)IR2
HEPTADECANOIC ACID(506-12-7)Raman
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

n-Heptadecanoic acid, 97%(506-12-7)
[Alfa Aesar]

Heptadecanoic acid, 98%(506-12-7)
[Sigma Aldrich]

506-12-7(sigmaaldrich)
[TCI AMERICA]

Heptadecanoic Acid,>98.0%(GC)(T)(506-12-7)
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