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505-52-2

Basic Information
CAS No.: 505-52-2
Name: 1,11-Undecanedicarboxylic acid
Article Data: 64
Molecular Structure:
Molecular Structure of 505-52-2 (1,11-Undecanedicarboxylic acid)
Formula: C13H24O4
Molecular Weight: 244.331
Synonyms: 1,13-Tridecanedioic acid;NSC 9498;Brassylic acid;a,w-Tridecanedioic acid;
EINECS: 208-011-4
Density: 1.051 g/cm3
Melting Point: 112-114 °C(lit.)
Boiling Point: 422.5 °C at 760 mmHg
Flash Point: 223.5 °C
Solubility: insoluble in water
Appearance: white powder
Hazard Symbols: IrritantXi
Risk Codes: 36/37/38
Safety: 26-37/39
PSA: 74.60000
LogP: 3.44670
Synthetic route
112-86-7

cis-13-docosenoic acid

A

112-05-0

nonanoic acid

B

505-52-2

brassylic acid

Conditions
ConditionsYield
With oxygen; ozone In water; acetone at 0℃; Flow reactor;A 74%
B 88%
37167-18-3

2cyclododecanonecarboxylic acid N-phenylamide

505-52-2

brassylic acid

Conditions
ConditionsYield
With sodium hydroxide; water In ethanol for 12h; Heating;86%
63498-96-4

5,6,7,8,9,10,11,12,13,14-decahydrocyclododeca<1,2-d>pyrimidine(1H,3H)-2,4-dione

505-52-2

brassylic acid

Conditions
ConditionsYield
With potassium hydroxide at 250 - 300℃; for 7h;67%
112-86-7

cis-13-docosenoic acid

505-52-2

brassylic acid

Conditions
ConditionsYield
With dihydrogen peroxide; ortho-tungstic acid In tert-butyl alcohol for 60h; Reflux;53%
With sodium periodate; ruthenium trichloride In water; ethyl acetate; acetonitrile for 2h;52%
With nitric acid
886-77-1

(E,E)-1,5-di-(2-furyl)pent-1,4-dien-3-one

505-52-2

brassylic acid

Conditions
ConditionsYield
With hydrogenchloride Hydrierung der entstandenen 4.7.10-Trioxotridecandisaeure (als Natriumsalz) an einem Nickelkatalysator in Wasser bei 200grad und 130 at Druck;
506-33-2

Brassidic acid

505-52-2

brassylic acid

Conditions
ConditionsYield
With chloroform; ozone
With ozone; acetic acid
4549-33-1

1,9-Dibromononane

996-82-7

sodium diethylmalonate

505-52-2

brassylic acid

Conditions
ConditionsYield
With ethanol at 125℃; Beim Verseifung und Erhitzen der Tetracarbonsaeure auf 180grad;
With ethanol Beim Verseifung und Erhitzen der Tetracarbonsaeure auf 180grad;
6006-37-7

tridecanedinitrile

505-52-2

brassylic acid

Conditions
ConditionsYield
With potassium hydroxide
With hydrogenchloride at 120℃;
2834-05-1

11-bromoundecanoic acid

996-82-7

sodium diethylmalonate

505-52-2

brassylic acid

Conditions
ConditionsYield
With ethanol Erwaermen des Reaktionsprodukts mit wss.Kalilauge und Erhitzen der erhaltenen Saeure auf 170grad;
6287-90-7

11-bromo-undecanoic acid methyl ester

996-82-7

sodium diethylmalonate

505-52-2

brassylic acid

Conditions
ConditionsYield
und Verseifen des entstehenden Undecantricarbonsaeureesters mit alkoholischer Kalilauge zur freie Saeure und Erhitzen diese auf ca.114grad;
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    505-52-2 CAS NO.505-52-2

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Chemistry

IUPAC Name: Tridecanedioic acid
Systematic of Tridecanedioic acid (CAS NO.505-52-2): 11,13-Tridecanedioic acid ; AI3-18168 ; EINECS 208-011-4 ; NSC 9498
CAS NO: 505-52-2
Molecular Formula of Tridecanedioic acid (CAS NO.505-52-2): C13H24O4
Molecular Weight: 244.3273
Molecular Structure:

Product Categories: Industrial/Fine Chemicals ; Miscellaneous Natural Products ; alpha,omega-Alkanedicarboxylic Acids ; alpha,omega-Bifunctional Alkanes ; Monofunctional & alpha,omega-Bifunctional Alkanes
Melting Point: 112-114 °C
Polar Surface Area: 52.6 Å2
Index of Refraction: 1.474
Molar Refractivity: 65.4 cm3
Molar Volume: 232.3 cm3
Surface Tension: 42.3 dyne/cm
Density of Tridecanedioic acid (CAS NO.505-52-2): 1.051 g/cm3
Flash Point: 223.5 °C
Enthalpy of Vaporization: 74.22 kJ/mol
Boiling Point: 422.5 °C at 760 mmHg
Vapour Pressure: 2.54E-08 mmHg at 25°C

Uses

Brassylic acid(505-52-2) has been used in the production of high flavor, perfume and artificial musk-T, hot melt adhesives, and engineering plastics.
Brassylic acid(505-52-2) is also advanced food packaging materials and the main raw material for high-grade nylon 1313.

Production

Cerived with Erucic acidl extracted by special  rapeseed oi, by a further decomposition after ozone's oxidation.
In addition, straight-chain alkanes with the raw materials, but also can be from the synthetic of the straight-chain olefins, saturated or unsaturated fatty acids, 16 (alkyl) ester.

Safety Profile

Hazard Codes: IrritantXi
Risk Statements: 36/37/38 
R36/37/38: Irritating to eyes, respiratory system and skin.
Safety Statements: 26-37/39 
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. 
S37/39: Wear suitable gloves and eye/face protection.
WGK Germany: 3
HS Code: 29171990