CAS 132-60-5 2-Phenyl-4-quinolinecarboxylic acid

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2-Phenyl-4-quinolinecarboxylic acid

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Catalog Number

ACM132605

Product Name

2-Phenyl-4-quinolinecarboxylic acid

Structure

CAS

132-60-5

Category

Ligands for Functional Metal Complexes

IUPAC Name

2-phenylquinoline-4-carboxylic acid

Molecular Weight

249.26g/mol

Molecular Formula

C16H11NO2

Canonical SMILES

C1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)O

InChI

InChI=1S/C16H11NO2/c18-16(19)13-10-15(11-6-2-1-3-7-11)17-14-9-5-4-8-12(13)14/h1-10H,(H,18,19)

InChI Key

YTRMTPPVNRALON-UHFFFAOYSA-N

Melting Point

214.5 °C;218 °C

Purity

99%

Solubility

6.42e-04 M;SOLUBLE IN HOT ALCOHOL, ALKALI; SLIGHTLY SOL IN HOT ACETONE, HOT BENZENE; INSOLUBLE IN PETROLEUM ETHER, WATER;1 G DISSOLVES IN ABOUT: 400 ML CHLOROFORM, 100 ML ETHER, 120 ML ALCOHOL

Appearance

Off White to Faint Yellow Powder

Color/Form

NEEDLES FROM METHANOL OR DILUTED ALCOHOL;WHITE OR YELLOWISH CRYSTALS OR POWDER;SMALL, WHITE, NEEDLE-LIKE CRYSTALS

Complexity

325

Covalently-Bonded Unit Count

EC Number

205-067-1

Exact Mass

249.078979g/mol

Formal Charge

Heavy Atom Count

MeSH Entry Terms

aciphenochinolium;Atofan;cinchophen

Monoisotopic Mass

249.078979g/mol

NSC Number

758887;70178;2617

Odor

ODORLESS

Other Experimental

OPTIC SIGN: +; ELONGATION: +; AXIAL ANGLE: 2V= 45 DEG /ORTHORHOMBIC SYSTEM/;OPTIC SIGN: -; AXIAL ANGLE: LARGE /TRICLINIC SYSTEM/;YELLOW CRYSTALLINE POWDER; SLIGHTLY BITTER, ASTRINGENT TASTE; MP: 223 °C; PRACTICALLY INSOL IN WATER; SLIGHTLY SOL IN ALCOHOL; SOL IN CHLOROFORM, ETHER /HYDROCHLORIDE/;RAPIDLY LOSES WATER OF CRYSTALLIZATION ON EXPOSURE TO AIR; SOL IN WATER, ALC; PRACTICALLY INSOL IN ETHER /LITHIUM SALT OCTAHYDRATE/

Refractive Index

INDEX OF REFRACTION IN ORTHORHOMBIC SYSTEM: 1.545 (ALPHA), 1.575 (BETA), EXCEEDS 1.734 (GAMMA); INDEX OF REFRACTION IN TRICLINIC SYSTEM: 1.545 (ALPHA), 1.590 (BETA), 1.630 (GAMMA); INDEX OF REFRACTION IN TRICLINIC SYSTEM: 1.545 (ALPHA), 1.590 (BETA), 1.630 (GAMMA)

Rotatable Bond Count

Stability

STABLE TO AIR, BUT TURNS YELLOW UNDER THE INFLUENCE OF LIGHT

UNII

39Y533Z02M

XLogP3

3.4

MSDS

Download MSDS

COA

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Spec Sheet