Benzotetronic Acid | CAS#1076-38-6 | C. corniculatus coumarin

Benzotetronic Acid
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WARNING: This product is for research use only, not for human or veterinary use.

MedKoo CAT#: 464420

CAS#: 1076-38-6

Description: 4-Hydroxycoumarin is a coumarin that has been found in C. corniculatus. It inhibits vitamin K1 epoxidation and prothrombin synthesis by 18 and 67%, respectively, in cell-free assays when used at a concentration of 6.2 mM. 4-Hydroxycoumarin has been used in the synthesis of anticoagulants, as well as antithrombotic, anti-inflammatory, antibacterial, and antifungal agents.

Chemical Structure

Benzotetronic Acid

CAS# 1076-38-6

Instruction

Theoretical Analysis

MedKoo Cat#: 464420
Name: Benzotetronic Acid
CAS#: 1076-38-6
Chemical Formula: C9H6O3
Exact Mass: 162.03
Molecular Weight: 162.144
Elemental Analysis: C, 66.67; H, 3.73; O, 29.60

Price and Availability

Size	Price	Availability
25g	USD 250	2 Weeks
100g	USD 500	2 Weeks
Bulk inquiry Welcome, Customer: Please do not inquire quote if your intended use is for a patient since our products are for research use and for chemical synthesis use, not for human use . For in-stock products, we listed price in the web page. You may inquire prices for which sizes were not listed. If no price is listed, this means the product is not in stock at the moment, which may be available via custom synthesis. For cost-effective reason, minimum order of 1g is requested (typically very expensive). The lead time is usually 2-4 months. Quote of less than 1g will not be provided. MedKoo may not offer quote for below reasons: (1) current available synthetic method appears to be extremely expensive which is obviously not affordable to most customers; (2) Key raw material to make the product is temporally not available; (3) DEA controlled substances; (4) the product is under patent protection in customer’s country.

Synonym: Benzotetronic Acid; 4-Hydroxycoumarin; 4 Hydroxycoumarin; 4-Coumarinol; 4 Coumarinol; NSC 11889; NSC11889; NSC-11889;

IUPAC/Chemical Name: 4-hydroxy-2H-chromen-2-one

InChi Key: VXIXUWQIVKSKSA-UHFFFAOYSA-N

InChi Code: InChI=1S/C9H6O3/c10-7-5-9(11)12-8-4-2-1-3-6(7)8/h1-5,10H

SMILES Code: O=C1OC2=C(C=CC=C2)C(O)=C1

Appearance: Solid powder

Purity: >98% (or refer to the Certificate of Analysis)

Shipping Condition: Shipped under ambient temperature as non-hazardous chemical. This product is stable enough for a few weeks during ordinary shipping and time spent in Customs.

Storage Condition: Dry, dark and at 0 - 4 C for short term (days to weeks) or -20 C for long term (months to years).

Solubility: To be determined

Shelf Life: >2 years if stored properly

Drug Formulation: To be determined

Stock Solution Storage: 0 - 4 C for short term (days to weeks), or -20 C for long term (months).

HS Tariff Code: 2934.99.9001

More Info:

Instruction:

View handling instruction

Biological target:
In vitro activity:
In vivo activity:

Solubility Data

	Solvent	Max Conc. mg/mL	Max Conc. mM
Solubility
	DMF	30.0	0.00
	DMSO	30.0	0.00
	Ethanol	30.0	0.00
	Ethanol:PBS (pH 7.2) (1:5)	0.2	0.00

Preparing Stock Solutions

The following data is based on the product molecular weight 162.14 Batch specific molecular weights may vary from batch to batch due to the degree of hydration, which will affect the solvent volumes required to prepare stock solutions.

Concentration / Solvent Volume / Mass	1 mg	5 mg	10 mg
1 mM	1.15 mL	5.76 mL	11.51 mL
5 mM	0.23 mL	1.15 mL	2.3 mL
10 mM	0.12 mL	0.58 mL	1.15 mL
50 mM	0.02 mL	0.12 mL	0.23 mL

Formulation protocol:
In vitro protocol:
In vivo protocol:

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*When preparing stock solutions always use the batch-specific molecular weight of the product found on the vial label and SDS / CoA (available online).

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Benzotetronic Acid featured