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CAS No.: | 1562-85-2 |
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Name: | GALLOCYANINE |
Molecular Structure: | |
Formula: | C15H13ClN2O5 |
Molecular Weight: | 336.73 |
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; |
EINECS: | 216-345-7 |
Density: | 1.3979 (rough estimate) |
Boiling Point: | 497oC at 760 mmHg |
Flash Point: | 254.4oC |
Solubility: | Soluble in water (10 mg/ml), 100% ethanol (10 mg/ml), alcohol, 1N NH4OH (10 mg/ml), and DMSO (25 mg/ml). |
Appearance: | Black powder |
Hazard Symbols: | Xn |
Risk Codes: | 22 |
Safety: | 36/37 |
PSA: | 107.03000 |
LogP: | -0.55850 |
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 |
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rat | LD | oral | > 500mg/kg (500mg/kg) | National Academy of Sciences, National Research Council, Chemical-Biological Coordination Center, Review. Vol. 5, Pg. 12, 1953. |