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CAS No.: | 530-57-4 |
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Name: | Syringic acid |
Article Data: | 51 |
Molecular Structure: | |
Formula: | C9H10O5 |
Molecular Weight: | 198.175 |
Synonyms: | Syringicacid (6CI);2,6-Dimethoxy-4-carboxyphenol;3,5-Dimethoxy-4-hydroxybenzoic acid;4-Hydroxy-3,5-dimethoxybenzoic acid;Cedar acid;Gallic acid 3,5-dimethylether;NSC 2129; |
EINECS: | 208-486-8 |
Density: | 1.335 g/cm3 |
Melting Point: | 205-209 °C(lit.) |
Boiling Point: | 379.5 °C at 760 mmHg |
Flash Point: | 155 °C |
Solubility: | 5780 mg/L (25 °C) in water |
Appearance: | light brown powder |
Hazard Symbols: | Xi |
Risk Codes: | 36/37/38 |
Safety: | 26-36-37/39 |
PSA: | 75.99000 |
LogP: | 1.10760 |
Product Name: Syringic acid (CAS NO.530-57-4)
Molecular Formula: C9H10O5
Molecular Weight: 198.172700 g/mol
Appearance: gray-beige to light brown powder
Melting Point: 205-209 °C(lit.)
Boiling Point: 192-193 °C 14mm Hg
Flash Point: 155 °C
Density: 1.335g/cm3
Solubility: soluble in ethanol, ethyl ether, slightly soluble in water and chloroform
Water Solubility: 5780 mg/L (25 °C)
BRN: 2115262
EINECS: 208-486-8
Index of Refraction: 1.566
Molar Refractivity: 48.42 cm3
Molar Volume: 148.3 cm3
Surface Tension: 51.6 dyne/cm
Enthalpy of Vaporization: 66.19 kJ/mol
Vapour Pressure: 1.96E-06 mmHg at 25°C
XLogP3-AA: 1
H-Bond Donor: 2
H-Bond Acceptor: 5
Structure Descriptors of Syringic acid (CAS NO.530-57-4):
IUPAC Name: 4-hydroxy-3,5-dimethoxybenzoic acid
Canonical SMILES: COC1=CC(=CC(=C1O)OC)C(=O)O
InChI: InChI=1S/C9H10O5/c1-13-6-3-5(9(11)12)4-7(14-2)8(6)10/h3-4,10H,1-2H3,(H,11,12)
InChIKey: JMSVCTWVEWCHDZ-UHFFFAOYSA-N
Categories: FINE Chemical & INTERMEDIATES; Aromatic Carboxylic Acids, Amides, Anilides, Anhydrides & Salts; Benzoic acid; Organic acids; Acids & Esters; Anisoles, Alkyloxy Compounds & Phenylacetates; Phenols; Pharmaceutical Intermediate
Syringic acid (CAS NO.530-57-4) is widely used in medicine, perfume, pesticide chemical and organic synthesis industry.
1. | cyt-ham:ovr 3 g/L | CALEDQ Cancer Letters (Shannon, Ireland). 14 (1981),251. |
Reported in EPA TSCA Inventory.
Safety Information of Syringic acid (CAS NO.530-57-4):
Hazard Codes:Xi
Risk Statements:36/37/38
36/37/38:Irritating to eyes, respiratory system and skin
Safety Statements:26-36-37/39
26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice
36:Wear suitable protective clothing
37/39:Wear suitable gloves and eye/face protection
WGK Germany:3
RTECS:DH2090000
Hazard Note:Irritant
HS Code:29189090
Mutation data reported. When heated to decomposition it emits acrid smoke and irritating vapors.
Syringic acid , its CAS NO. is 530-57-4, the synonyms are 3,5-Dimethoxy-4-hydroxybenzoic acid 3,5-Dimethoxy-4-hydroxybenzyl acid ; 4-Hydroxy-3,5-dimethoxybenzoic acid ; Gallic acid 3,5-dimethyl ether ; Benzoic acid, 4-hydroxy-3,5-dimethoxy- .