CAS No.588720-42-7,indolizine-6-carboxylic acid Suppliers

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Basic Information

Molecular Structure:
CAS No.:	588720-42-7
Name:	indolizine-6-carboxylic acid

Formula:	C₉H₇NO₂
Molecular Weight:	161.15738
Synonyms:	Indolizine-6-carboxylic acid;
Density:	1.282 g/cm³
PSA:	41.71000
LogP:	1.63750

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Specification

The 6-Indolizinecarboxylicacid, with the CAS registry number of 588720-42-7, is also known as 6-Indolizinecarboxylicacid (9CI). It belongs to the product category of Aminetertiary. This chemical's molecular formula is C₉H₇NO₂ and molecular weight is 161.15738. What's more, its systematic name is called Indolizine-6-carboxylic acid.

Physical properties about 6-Indolizinecarboxylicacid are: (1)ACD/LogP: 1.99; (2)# of Rule of 5 Violations: 0; (3)ACD/BCF (pH 5.5): 1; (4)ACD/BCF (pH 7.4): 1; (5)ACD/KOC (pH 5.5): 1; (6)ACD/KOC (pH 7.4): 1; (7)#H bond acceptors: 3; (8)#H bond donors: 1; (9)#Freely Rotating Bonds: 1; (10)Polar Surface Area: 41.71 Å²; (11)Index of Refraction: 1.628; (12)Molar Refractivity: 44.581 cm³; (13)Molar Volume: 125.693 cm³; (14)Surface Tension: 52.102 dyne/cm; (15)Density: 1.282 g/cm³.

You can still convert the following datas into molecular structure:
(1) SMILES: OC(=O)c1ccc2cccn2c1
(2) InChI: InChI=1/C9H7NO2/c11-9(12)7-3-4-8-2-1-5-10(8)6-7/h1-6H,(H,11,12)
(3) InChIKey: JOVCSPPLSDQUOO-UHFFFAOYAR