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Gallocyanine

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Name

Gallocyanine

EINECS 216-345-7
CAS No. 1562-85-2 Density 1.3979 (rough estimate)
PSA 107.03000 LogP -0.55850
Solubility Soluble in water (10 mg/ml), 100% ethanol (10 mg/ml), alcohol, 1N NH4OH (10 mg/ml), and DMSO (25 mg/ml). Melting Point N/A
Formula C15H13ClN2O5 Boiling Point 497oC at 760 mmHg
Molecular Weight 336.73 Flash Point 254.4oC
Transport Information N/A Appearance Black powder
Safety 36/37 Risk Codes 22
Molecular Structure Molecular Structure of 1562-85-2 (GALLOCYANINE) Hazard Symbols HarmfulXn
Synonyms

C.I.Mordant Blue 10 (7CI,8CI);Gallocyanine (6CI);Phenoxazin-5-ium, 1-carboxy-7-(dimethylamino)-3,4-dihydroxy-,chloride (9CI);Alizarine Navy Blue;Alizarine Navy Blue AT;Anthracene BlueSWGG;Brilliant Chrome Blue P;C.I. 51030;Fast violet;Gallocyanin;Gallocyanine BS;Gallocyanine DH;

 

Gallocyanine Specification

The Phenoxazin-5-ium,1-carboxy-7-(dimethylamino)-3,4-dihydroxy-, chloride is an organic compound with the formula C15H13ClN2O5. The IUPAC name of this chemical is 7-(Dimethylamino)-4-hydroxy-3-oxophenoxazin-10-ium-1-carboxylic acid chloride. With the CAS registry number 1562-85-2, it is also named as 1-Carboxy-7-(dimethylamino)-3,4-dihydroxyphenoxazin-5-ium chloride. Besides, it is black powder, which should be stored in a cool, sealed, dry place. It can be used as redox indicator.

Physical properties about Phenoxazin-5-ium,1-carboxy-7-(dimethylamino)-3,4-dihydroxy-, chloride are: (1)#H bond acceptors: 7; (2)#H bond donors: 3; (3)#Freely Rotating Bonds: 4; (4)Polar Surface Area: 107.03 Å2.

When you are using this chemical, please be cautious about it as the following:
It is harmful if swallowed. When you are using it, wear suitable protective clothing and gloves.

You can still convert the following datas into molecular structure:
(1)InChI: InChI=1/C15H12N2O5.ClH/c1-17(2)7-3-4-9-11(5-7)22-14-12(16-9)8(15(20)21)6-10(18)13(14)19;/h3-6H,1-2H3,(H2-,16,18,19,20,21);1H
(2)InChIKey: ADAUKUOAOMLVSN-UHFFFAOYAJ
(3)Std. InChI: InChI=1S/C15H12N2O5.ClH/c1-17(2)7-3-4-9-11(5-7)22-14-12(16-9)8(15(20)21)6-10(18)13(14)19;/h3-6H,1-2H3,(H2-,16,18,19,20,21);1H
(4)Std. InChIKey: ADAUKUOAOMLVSN-UHFFFAOYSA-N

The toxicity data is as follows:

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD oral > 500mg/kg (500mg/kg)   National Academy of Sciences, National Research Council, Chemical-Biological Coordination Center, Review. Vol. 5, Pg. 12, 1953.

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