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Basic information

  • Name:
  • Sebacic acid

  • CAS No.:
  • 111-20-6

  • Molecular Structure:
  • Formula:
  • C10H18O4
  • Molecular Weight:
  • 202.28
  • Synonyms:
  • Sebacic acids;1, 10-Decanedioic acid;Sebacicacid;1,10-decanedioic acid;Sebacinsaeure;Decanedioic acid;Usaf hc-1;Decanedicarboxylic acid;1,8-Octanedicarboxylic acid;
  • EINECS:
  • 203-845-5
  • Density:
  • 1.106 g/cm3
  • Melting Point:
  • 131–134.5 °C
  • Boiling Point:
  • 374.3 °C at 760 mmHg
  • Flash Point:
  • 198.3 °C
  • Solubility:
  • 1 g/L in water
  • Appearance:
  • white powder
  • Hazard Symbols:
  • IrritantXi
  • Risk Codes:
  • 36/37/38
  • Safety Description:
  • 26-36 Details

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Chemistry

Molecular Structure of Sebacic acid (CAS NO.111-20-6):

IUPAC Name: decanedioic acid 
Empirical Formula: C10H18O4
Molecular Weight: 202.2475
H bond acceptors: 4
H bond donors: 2
Freely Rotating Bonds: 9
Index of Refraction: 1.475
Molar Refractivity: 51.5 cm3
Molar Volume: 182.8 cm3
Surface Tension: 44.9 dyne/cm
Density: 1.106 g/cm3
Flash Point: 198.3 °C
Enthalpy of Vaporization: 68.26 kJ/mol
Boiling Point: 374.3 °C at 760 mmHg
Vapour Pressure: 1.24E-06 mmHg at 25°C
Water Solubility: 1 g/L (20 ºC)
Merck: 14,8415
BRN: 1210591
Stability: Stable. Combustible. Incompatible with strong oxidizing agents, bases, reducing agents
Melting point: 131–134.5 °C
Solubility in water: 0.25 g/L
InChI
InChI=1/C10H18O4/c11-9(12)7-5-3-1-2-4-6-8-10(13)14/h1-8H2,(H,11,12)(H,13,14)
Smiles
C(CCCCCCCCC(O)=O)(O)=O
EINECS: 203-845-5
Product Categories: Intermediates; alpha,omega-Alkanedicarboxylic Acids; alpha,omega-Bifunctional Alkanes; Monofunctional & alpha,omega-Bifunctional Alkanes; Organic Chemicals

Toxicity Data With Reference

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mammal (species unspecified) LC inhalation > 900mg/m3 (900mg/m3) SENSE ORGANS AND SPECIAL SENSES: OTHER CHANGES: OLFACTION

BEHAVIORAL: EXCITEMENT
Gigiena Truda i Professional'nye Zabolevaniya. Labor Hygiene and Occupational Diseases. Vol. 24(5), Pg. 48, 1980.
mammal (species unspecified) LD50 intraperitoneal 1175mg/kg (1175mg/kg)   Gigiena Truda i Professional'nye Zabolevaniya. Labor Hygiene and Occupational Diseases. Vol. 24(5), Pg. 48, 1980.
mammal (species unspecified) LD50 oral > 11gm/kg (11000mg/kg)   Gigiena i Sanitariya. For English translation, see HYSAAV. Vol. 48(9), Pg. 72, 1983.
mouse LD50 intraperitoneal 500mg/kg (500mg/kg)   National Technical Information Service. Vol. AD277-689,
mouse LD50 oral 6gm/kg (6000mg/kg)   Biochemical Journal. Vol. 34, Pg. 1196, 1940.
rat LC50 inhalation > 4500mg/m3 (4500mg/m3)   Gigiena i Sanitariya. For English translation, see HYSAAV. Vol. 57(2), Pg. 17, 1992.
rat LD50 oral 14375mg/kg (14375mg/kg) BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)

BEHAVIORAL: EXCITEMENT

BEHAVIORAL: FOOD INTAKE (ANIMAL)
Gigiena i Sanitariya. For English translation, see HYSAAV. Vol. 57(2), Pg. 17, 1992.

Consensus Reports

Reported in EPA TSCA Inventory.

Safety Profile

Moderately toxic by ingestion and intraperitoneal routes. When heated to decomposition it emits acrid smoke and irritating fumes.
Hazard Codes: IrritantXi
Risk Statements: 36/37/38
R36/37/38:Irritating to eyes, respiratory system and skin.
Safety Statements: 26-36
S25:Avoid contact with eyes. 
S36:Wear suitable protective clothing.
WGK Germany: 1
RTECS: VS0875000
HS Code: 29171310

Specification

 Sebacic acid , with CAS number of 111-20-6, can be called decanedioic acid ; Sebacic acid ; 1, 10-Decanedioic acid ; 1,10-decanedioic acid ; Decanedioic acid ; 1,8-Octanedicarboxylic acid ; decanedioate . It is a white powder,  Sebacic acid (CAS NO.111-20-6) is also used as an intermediate for antiseptics,aromatics and painting materials. Sebacic acid (CAS NO.111-20-6) is a low toxic substance, with flammability, burning will produce toxic fumes, so it should be stored in cool and dry environment, dry powder, foam, sand, carbon dioxide, water mist can be used if something urgent happened.

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