IUPAC Name: 3,4-Dihydroxy-5-methoxybenzaldehyde
Synonyms of Benzaldehyde,3,4-dihydroxy-5-methoxy- (CAS NO.3934-87-0): 3,4-Dihydroxy-5-methoxybenzaldehyde ; 4-08-00-02718 (Beilstein Handbook Reference) ; 5-Hydroxyvanillin ; 5-Methoxyprotocatechualdehyde ; BRN 1956546 ; EINECS 223-513-3 ; NSC 16679 ; Protocatechualdehyde, 5-methoxy- ; Protocatechualdehyde, 5-methoxy- (8CI)
CAS NO: 3934-87-0
Classification Code: Drug / Therapeutic Agent
Molecular Formula: C8H8O4
Molecular Weight: 168.1467
Molecular Structure:
Melting Point: 131-134°C
H bond acceptors: 4
H bond donors: 2
Freely Rotating Bonds: 4
Polar Surface Area: 44.76 Å2
Index of Refraction: 1.63
Molar Refractivity: 43.44 cm3
Molar Volume: 121.9 cm3
Surface Tension: 59.7 dyne/cm
Density of Benzaldehyde,3,4-dihydroxy-5-methoxy- (CAS NO.3934-87-0): 1.378 g/cm3
Flash Point: 143.1 °C
Enthalpy of Vaporization: 60.65 kJ/mol
Boiling Point: 339.9 °C at 760 mmHg
Vapour Pressure: 4.54E-05 mmHg at 25°C
Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
---|---|---|---|---|---|
mouse | LD50 | intraperitoneal | 650mg/kg (650mg/kg) | BEHAVIORAL: ALTERED SLEEP TIME (INCLUDING CHANGE IN RIGHTING REFLEX) | Journal of Medicinal Chemistry. Vol. 7, Pg. 178, 1964. |
Hazard Codes of Benzaldehyde,3,4-dihydroxy-5-methoxy- (CAS NO.3934-87-0): Xi
Risk Statements: 36/37/38
R36/37/38: Irritating to eyes, respiratory system and skin.
Safety Statements: 26-36
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
S36: Wear suitable protective clothing.
RTECS: CU5620000
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