Welcome to LookChem.com Sign In|Join Free
  • or
Home > Products >  > 

Flavoxate

Related Products

Hot Products

Name

Flavoxate

EINECS 239-337-5
CAS No. 15301-69-6 Density 1.203 g/cm3
PSA 59.75000 LogP 4.34900
Solubility 10 mg/L at 37 °C in water Melting Point 87-88 °C
Formula C24H25NO4 Boiling Point 564.1 °C at 760 mmHg
Molecular Weight 391.467 Flash Point 294.9 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 15301-69-6 (FLAVOXATE) Hazard Symbols N/A
Synonyms

4H-1-Benzopyran-8-carboxylicacid, 3-methyl-4-oxo-2-phenyl-, 2-piperidinoethyl ester (6CI,8CI);2-Piperidinoethyl 3-methylflavone-8-carboxylate;Flavoxate;Piperidinoethyl3-methyl-2-phenyl-4-oxo-4H-1-benzopyran-8-carboxylate;b-Piperidinoethyl-3-methylflavone-8-carboxylate;2-Piperidinoethyl 3-methyl-4-oxo-2-phenyl-4H-1-benzopyran-8-carboxylat;

Article Data 7

Flavoxate Specification

The IUPAC name of Flavoxate is 2-piperidin-1-ylethyl 3-methyl-4-oxo-2-phenylchromene-8-carboxylate. With the CAS registry number 15301-69-6, it is also named as 2-Piperidinoethyl 3-methyl-4-oxo-2-phenyl-4H-1-benzopyran-8-carboxylat. The product's classification codes are Autonomic Agents; Parasympatholytics; Peripheral Nervous System Agents. It is an anticholinergic with antimuscarinic effects. In addition, its molecular formula is C24H25NO4 and molecular weight is 391.46.

The other characteristics of this product can be summarized as: (1)EINECS: 239-337-5; (2)ACD/LogP: 5.18; (3)# of Rule of 5 Violations: 1; (4)ACD/LogD (pH 5.5): 2.56; (5)ACD/LogD (pH 7.4): 4.23; (6)ACD/BCF (pH 5.5): 12.12; (7)ACD/BCF (pH 7.4): 573.29; (8)ACD/KOC (pH 5.5): 37.22; (9)ACD/KOC (pH 7.4): 1760.78; (10)#H bond acceptors: 5; (11)#H bond donors: 0; (12)#Freely Rotating Bonds: 6; (13)Index of Refraction: 1.591; (14)Molar Refractivity: 109.95 cm3; (15)Molar Volume: 325.1 cm3; (16)Surface Tension: 47.3 dyne/cm; (17)Density: 1.203 g/cm3; (18)Flash Point: 294.9 °C; (19)Enthalpy of Vaporization: 84.76 kJ/mol; (20)Boiling Point: 564.1 °C at 760 mmHg; (21)Water Solubility: 10 mg/L at 37 °C; (22)Vapour Pressure: 9.56E-13 mmHg at 25 °C.

Uses of Flavoxate: this chemical is used to treat urinary bladder spasms. Moreover, it is a drug that has been used in various urinary syndromes and as an antispasmodic. Besides, it may have local anesthetic activity and direct relaxing effects on smooth muscle as well as some activity as a muscarinic antagonist.

People can use the following data to convert to the molecule structure.
(1)SMILES: O=C(OCCN1CCCCC1)c4cccc2c4O/C(=C(\C2=O)C)c3ccccc3
(2)InChI: InChI=1/C24H25NO4/c1-17-21(26)19-11-8-12-20(23(19)29-22(17)18-9-4-2-5-10-18)24(27)28-16-15-25-13-6-3-7-14-25/h2,4-5,8-12H,3,6-7,13-16H2,1H3
(3)InChIKey: SPIUTQOUKAMGCX-UHFFFAOYAW
(4)Std. InChI: InChI=1S/C24H25NO4/c1-17-21(26)19-11-8-12-20(23(19)29-22(17)18-9-4-2-5-10-18)24(27)28-16-15-25-13-6-3-7-14-25/h2,4-5,8-12H,3,6-7,13-16H2,1H3
(5)Std. InChIKey: SPIUTQOUKAMGCX-UHFFFAOYSA-N

Post a RFQ

Enter 15 to 2000 letters.Word count: 0 letters

Attach files(File Format: Jpeg, Jpg, Gif, Png, PDF, PPT, Zip, Rar,Word or Excel Maximum File Size: 3MB)

1

What can I do for you?
Get Best Price

Get Best Price for 15301-69-6