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1,4-Benzodioxane-6-carboxylic acid - ≥98%, high purity , CAS No.4442-54-0

≥98%

CAS#: 4442-54-0
Formula: C₉H₈O₄
Molecular Weight: 180.16
MDL number: MFCD00463509
PubChem CID: 2758833

Item Number

B138847

Grouped product items
SKU	Size	Availability	Price
B138847-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$13.90
B138847-5g	5g	In stock	$52.90
B138847-10g	10g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$94.90
B138847-25g	25g	In stock	$146.90
B138847-100g	100g	In stock	$526.90

View related series

Dioxane Six-Membered Heterocyclic Compounds

Basic Description

Synonyms	4442-54-0\|2,3-dihydro-1,4-benzodioxine-6-carboxylic acid\|1,4-Benzodioxane-6-carboxylic acid\|2,3-dihydrobenzo[b][1,4]dioxine-6-carboxylic acid\|2,3-Dihydro-benzo[1,4]dioxine-6-carboxylic acid\|3,4-(Ethylenedioxy)benzoic acid\|3,4-ethylenedioxybenzoic acid\|CHE
Specifications & Purity	≥98%
Shipped In	Normal

Associated Targets

DHRS9 Tbio Dehydrogenase/reductase SDR family member 9 0 Activities

Discover Target: DHRS9

Activity Type	Activity Value -log(M)	Mechanism of Action	Activity Reference	Publications (PubMed IDs)

GNAS Tbio Protein ALEX 0 Activities

Discover Target: GNAS

Activity Type	Activity Value -log(M)	Mechanism of Action	Activity Reference	Publications (PubMed IDs)

IDH1 Tclin Isocitrate dehydrogenase [NADP] cytoplasmic 0 Activities

Discover Target: IDH1

Activity Type	Activity Value -log(M)	Mechanism of Action	Activity Reference	Publications (PubMed IDs)

Names and Identifiers

IUPAC Name	2,3-dihydro-1,4-benzodioxine-6-carboxylic acid
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)
InChi Key	JWZQJTGQFHIRFQ-UHFFFAOYSA-N
Canonical SMILES	C1COC2=C(O1)C=CC(=C2)C(=O)O
Isomeric SMILES	C1COC2=C(O1)C=CC(=C2)C(=O)O
WGK Germany	3
PubChem CID	2758833
Molecular Weight	180.16
Reaxy-Rn	177824

Certificates

Certificate of Analysis(COA)

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4 results found

Lot Number	Certificate Type	Date	Item
L2315090	Certificate of Analysis	Dec 20, 2023	B138847
J2130407	Certificate of Analysis	Aug 02, 2023	B138847
J2130408	Certificate of Analysis	Aug 02, 2023	B138847
K2101014	Certificate of Analysis	Aug 02, 2023	B138847

Solubility

Soluble in methanol

Melt Point(°C)

138 °C

Safety and Hazards(GHS)

Pictogram(s)	GHS07
Signal	Warning
Hazard Statements	H315:Causes skin irritation H319:Causes serious eye irritation H335:May cause respiratory irritation
Precautionary Statements	P261:Avoid breathing dust/fume/gas/mist/vapors/spray. P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses if present and easy to do - continue rinsing. P280:Wear protective gloves/protective clothing/eye protection/face protection. P302+P352:IF ON SKIN: wash with plenty of water. P321:Specific treatment (see ... on this label). P405:Store locked up. P501:Dispose of contents/container to ... P264:Wash hands [and …] thoroughly after handling. P271:Use only outdoors or in a well-ventilated area. P304+P340:IF INHALED: Remove person to fresh air and keep comfortable for breathing. P403+P233:Store in a well-ventilated place. Keep container tightly closed. P362+P364:Take off contaminated clothing and wash it before reuse. P264+P265:Wash hands [and …] thoroughly after handling. Do not touch eyes. P337+P317:If eye irritation persists: Get medical help. P332+P317:If skin irritation occurs: Get medical help. P319:Get medical help if you feel unwell.
WGK Germany	3
Reaxy-Rn	177824

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