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Basic information

  • Name:
  • p-Anisaldehyde

  • CAS No.:
  • 123-11-5

  • Molecular Structure:
  • Formula:
  • C8H8O2
  • Molecular Weight:
  • 136.15 .
  • Deleted CAS:
  • 26249-15-0|68894-36-0|721942-53-6
  • Synonyms:
  • p-Formylanisole;p-Methoxybenzaldehyde;4-Anisaldehyde;4-Methoxybenzaldehyde;Anisaldehyde;Anisic aldehyde;Aubepine;Crategine;NSC 5590;Obepin;p-Anisic aldehyde;
  • EINECS:
  • 204-602-6
  • Density:
  • 1.088 g/cm3
  • Melting Point:
  • -1 ºC
  • Boiling Point:
  • 248 ºC at 760 mmHg
  • Flash Point:
  • 108.9 ºC
  • Appearance:
  • Clear to slight yellow liquid
  • Hazard Symbols:
  • HarmfulXn
  • Risk Codes:
  • 22-36/37/38-39-23/24/25-11
  • Safety Description:
  • 26-45-36/37-16-7 Details
  • Transport Information:
  • UN 3316 9/PG 2

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Chemistry

IUPAC Name: 4-Methoxybenzaldehyde
Synonyms of p-Anisaldehyde (CAS NO.123-11-5): 4-Anisaldehyde ; 4-Methoxybenzaldehyde ; AI3-00223 ; Anisic aldehyde ; Aubepine ; Benzaldehyde, 4-methoxy- ; CCRIS 821 ; Caswell No. 051E ; Crategine ; EINECS 204-602-6 ; FEMA No. 2670 ; Formylanisole, p- ; HSDB 2641 ; NSC 5590 ; Obepin ; UNII-9PA5V6656V ; p-Anisic aldehyde ; p-Formylanisole ; p-Methoxybenzaldehyde ; p-Methoxybenzaldehyde (natural) ; Anisaldehyde
CAS NO: 123-11-5
Classification Code: Mutation data ; Natural Product ; Skin / Eye Irritant ;
Molecular Formula of p-Anisaldehyde (CAS NO.123-11-5): C8H8O2
Molecular Weight: 136.1479
Molecular Structure:

Melting Point: -1 °C
Polar Surface Area: 26.3 Å2
Index of Refraction: 1.547
Molar Refractivity: 39.68 cm3
Molar Volume: 125.1 cm3
Surface Tension: 37.2 dyne/cm
Density of p-Anisaldehyde (CAS NO.123-11-5): 1.088 g/cm3
Flash Point: 108.9 °C
Enthalpy of Vaporization: 48.52 kJ/mol
Boiling Point: 248 °C at 760 mmHg
Vapour Pressure: 0.0249 mmHg at 25°C

Uses

  p-ANISALDEHYDE(123-11-5) is mainly used for the preparation of vanilla, spices, apricot, butter, cinnamon and chocolate, caramel, cherry, walnuts, raspberry, strawberry, mint flavor. It can also be used for daily Flavor and Flavors. The pharmaceutical industry for the manufacture of anti-microbial drugs hydroxyl ammonia benzyl penicillin, is the anti-histamine drug intermediates.

Production

 p-Anisaldehyde (CAS NO.123-11-5) is made by the oxidation of anethole (the chief constituent of anise, star anise, and fennel oils).
  CH3OC6H4CH=CHCH3 → CH3OC6H4CH=O
Anethole is obtained from the higher-boiling fractions of pine oil.

Toxicity Data With Reference

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
guinea pig LD50 oral 1260mg/kg (1260mg/kg) BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY) Food and Cosmetics Toxicology. Vol. 2, Pg. 327, 1964.
mouse LD50 oral 1859mg/kg (1859mg/kg) GASTROINTESTINAL: NECROTIC GHANGES

GASTROINTESTINAL: OTHER CHANGES

LIVER: FATTY LIVER DEGERATION
Gigiena i Sanitariya. For English translation, see HYSAAV. Vol. 58(8), Pg. 20, 1993.
rabbit LD50 skin > 5gm/kg (5000mg/kg)   Food and Cosmetics Toxicology. Vol. 12, Pg. 823, 1974.
rat LD50 oral 1510mg/kg (1510mg/kg) BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY) Food and Cosmetics Toxicology. Vol. 2, Pg. 327, 1964.

Consensus Reports

Reported in EPA TSCA Inventory.

Safety Profile

Hazard Codes: HarmfulXn,IrritantXi,ToxicT,FlammableF
Risk Statements: 22-36/37/38-39-23/24/25-11 
R22: Harmful if swallowed. 
R36/37/38: Irritating to eyes, respiratory system and skin. 
R39: Danger of very serious irreversible effects. 
R23/24/25: Toxic by inhalation, in contact with skin and if swallowed. 
R11: Highly flammable.
Safety Statements: 26-45-36/37-16-7 
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. 
S45: In case of accident or if you feel unwell, seek medical advice immediately (show the label whenever possible.) 
S36/37: Wear suitable protective clothing and gloves. 
S16: Keep away from sources of ignition. 
S7: Keep container tightly closed.
RIDADR: UN 3316 9/PG 2
WGK Germany: 1
RTECS: BZ2625000
F: 10-23
HazardClass: IRRITANT
HS Code: 29124900
Moderately toxic by ingestion. A skin irritant. Mutation data reported. Combustible liquid. When heated to decomposition it emits acrid smoke and irritating fumes.

Specification

Precautions: Do not ingest. Do not breathe gas/fumes/vapor/spray. Keep away from heat. Keep away from sources of ignition. Avoid contact with skin and eyes. Empty containers pose a fire risk, evaporate the residue under a fume hood. Ground all equipment containing material. Wear suitable protective clothing. In case of insufficient ventilation, wear suitable respiratory equipment. If ingested, seek medical advice immediately and show the container or the label.
Storage: Keep container in a cool, well-ventilated area. Keep container tightly closed.

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