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CAS No.: 4442-54-0
Name: 1,4-Benzodioxane-6-carboxylic acid
Article Data: 2
Molecular Structure:
Molecular Structure of 4442-54-0 (1,4-Benzodioxane-6-carboxylic acid)
Formula: C9H8O4
Molecular Weight: 180.16
Synonyms: 2,3-Dihydro-1,4-benzodioxine-6-carboxylic acid;3,4-(Ethylenedioxy)benzoic acid;2,3-dihydrobenzo[b][1,4]dioxine-6-carboxylic acid;7,10-dioxabicyclo[4.4.0]deca-2,4,11-triene-3-carboxylate;
Density: 1.377 g/cm3
Melting Point: 134-138 °C(lit.)
Boiling Point: 339.781 °C at 760 mmHg
Flash Point: 141.994 °C
Appearance: White Crystalloid powder
Hazard Symbols: IrritantXi
Risk Codes: 36/37/38
Safety: 26-36
PSA: 55.76000
LogP: 1.15600
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    4442-54-0

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  • 1,4-Benzodioxane-6-carboxylic acid

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    4442-54-0

    1,4-Benzodioxane-6-carboxylic acid

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    4442-54-0

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    4442-54-0

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  • CAS:4442-54-0 C9H8O4

  • Casno:

    4442-54-0

    CAS:4442-54-0 C9H8O4

    Min.Order: 0 Metric Ton

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    1,4-Benzodioxane-6-carboxylic acid Basic information Product Name: 1,4-Benzodioxane-6-carboxylic acid Synonyms: RARECHEM AL BO 1905;TIMTEC-BB SBB007047;2,3-DIHYDRO-

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Chemistry

IUPAC Name: 2,3-dihydro-1,4-benzodioxine-7-carboxylic acid 
Empirical Formula: C9H8O4
Molecular Weight: 180.1574g/mol
Structure of 1,4-Benzodioxane-6-carboxylic acid (CAS NO.4442-54-0):

Index of Refraction: 1.586
Molar Refractivity: 43.95 cm3
Molar Volume: 130.8 cm3
Polarizability: 17.42×10-24cm3
Surface Tension: 60.3 dyne/cm
Density: 1.376 g/cm3
Flash Point: 142 °C
Enthalpy of Vaporization: 61.56 kJ/mol 
Melting Point: 134-138 °C(lit.)
Boiling Point: 339.8 °C at 760 mmHg
Vapour Pressure: 3.48E-05 mmHg at 25°C 
Product Categories: Benzodiozoles, Benzodioxines & Benzodioxepines;Carboxylic Acids;Benzodiozoles, Benzodioxines & Benzodioxepines;Carboxylic Acids;Benzodioxanes;Building Blocks;Heterocyclic Building Blocks 
Canonical SMILES: C1COC2=C(O1)C=CC(=C2)C(=O)O
InChI: InChI=1S/C9H8O4/c10-9(11)6-1-2-7-8(5-6)13-4-3-12-7/h1-2,5H,3-4H2,(H,10,11)
InChIKey: JWZQJTGQFHIRFQ-UHFFFAOYSA-N

Safety Profile

Hazard Codes: IrritantXi
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.
WGK Germany: 3
HazardClass: IRRITANT

Specification

  1,4-Benzodioxane-6-carboxylic acid , its cas register number is 4442-54-0. It also can be called 2,3-Dihydro-1,4-benzodioxine-6-carboxylic acid ; Acide 2,3-dihydro-1,4-benzodioxine-6-carboxylique . 1,4-Benzodioxane-6-carboxylic acid (CAS NO.4442-54-0) is irritating to eyes, respiratory system and skin.