Xanthylium,9-(2-carboxyphenyl)-3,6-bis(diethylamino)-, chloride (1:1) (cas 81-88-9) Molecular Structure

CAS No. 81-88-9 (Xanthylium,9-(2-carboxyphenyl)-3,6-bis(diethylamino)-, chloride (1:1) )

Molecular Formula: C28H31N2O3.ClMolecular Formula: 479.02

Identification of 81-88-9

Name:
Xanthylium,9-(2-carboxyphenyl)-3,6-bis(diethylamino)-, chloride (1:1) (Related Reference)
EINECS:
201-383-9
Molecular Formula:
C28H31N2O3.Cl
CAS Registry Number:
81-88-9
Synonyms:
Rhodamine BXL;Rhodamine BXP;Rhodamine Lake Red B;Rhodamine O;Rhodamine S (Russian);Rhodamine, tetraethyl-;Sicilian Cerise Toner A 7127;Sumiplast Pink B;Symulex Magenta F;Symulex Rhodamine B Toner F;TakaokaRhodamine B;Calcozine Rhodamine BXP;Cerise Toner X1127;Chromatint Rhodamine B;D and C Red No. 19;C RedNo. 19;Diabasic Rhodamine B;Eriosin Rhodamine B;FD And C Red No. 19;Flexo Red 540;Hexacol Rhodamine BExtra;Ikada Rhodamine B;Japan Red No. 213;OP 312;Red No. 213;Rhodamine B;Rhodamine B Extra;Rhodamine B Extra M 310;Rhodamine BA;Rhodamine BAExport;11411 Red;ADC Rhodamine B;AizenRhodamine BH;Akiriku Rhodamine B;BasicRose Extract;Basonyl Red 540;Basonyl Red 545FL;C.I. Basic Violet 10;Calcozine Red BX;
InChI:
InChI=1/C28H30N2O3.ClH/c1-5-29(6-2)19-13-15-23-25(17-19)33-26-18-20(30(7-3)8-4)14-16-24(26)27(23)21-11-9-10-12-22(21)28(31)32;/h9-18H,5-8H2,1-4H3;1H
HS Code:
32041300
Molecular Structure:
Xanthylium,9-(2-carboxyphenyl)-3,6-bis(diethylamino)-, chloride (1:1) C28H31N2O3.Cl (cas 81-88-9) Molecular Structure
This structure is also available as a 2d Mol file

Chemical Properties

Appearance:
red to violet powder
Molecular Weight:
479.02
Density:
1.31
Melting Point:
210-211℃ (dec.)
Flash Point:
12?°C
Storage Temperature:
Store at RT.
Solubility:
Very soluble (soluble in alcohol) AU
Stability:
Stable. Incompatible with strong oxidizing agents.
Usage:

As dye, esp for paper, as reagent for antimony, bismuth, cobalt, niobium, gold, manganese, mercury, molybdenum, tantalum, thallium, tungsten, as biological stain.

Safety Data of 81-88-9

Risk Codes:
R22;R41;R68
Safety Statements:
S26;S36/37/39
MSDS infomation:
Xanthylium,9-(2-carboxyphenyl)-3,6-bis(diethylamino)-, chloride (1:1) (81-88-9).msds
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MSDS Documents

1.Sigma-Aldrich www.sigmaaldrich.com:
2.Fisher Scientific fscimage.fishersci.com/msds/95508.htm:
3.Science Lab www.sciencelab.com/msds.php?msdsId=9924812:
4.Sigma-Aldrich www.sigmaaldrich.com:
5.Fisher Scientific fscimage.fishersci.com/msds/95508.htm:
6.Science Lab www.sciencelab.com/msds.php?msdsId=9924812:

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References of Xanthylium,9-(2-carboxyphenyl)-3,6-bis(diethylamino)-, chloride (1:1)

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 144mg/kg (144mg/kg) ? "Recent Advances of Chemistry and Molecular Biology in Cancer Research, Insternational Symposium on Recent Advances of Chemistry and Molecular Biology in Cancer Research, Held in Beijing/China, July 23rd-26th, 1991" Dai Qianhuan, Margaret-Ann Armour and Zheng Qingying eds. Science Press Vol. -, Pg. 281, 1993.
mouse LD50 oral 887mg/kg (887mg/kg) ? Toxicological European Research. Vol. 1, Pg. 23, 1978.
mouse LD50 subcutaneous 180mg/kg (180mg/kg) ? Osaka-furitsu Koshu Eisei Kenkyusho Kenkyu Hokoku, Koshu Eisei Hen. Research Reports of the Oaka Prefectural Institute of Public Health, Public Health Section. Vol. (3), Pg. 185, 1953.
rat LD50 intraperitoneal 112mg/kg (112mg/kg) ? Toxicological European Research. Vol. 1, Pg. 23, 1978.
rat LD50 intravenous 89mg/kg (89mg/kg) ? Toxicology and Applied Pharmacology. Vol. 3, Pg. 696, 1961.
rat LDLo oral 500mg/kg (500mg/kg) ? National Academy of Sciences, National Research Council, Chemical-Biological Coordination Center, Review. Vol. 5, Pg. 8, 1953.

Safety

Hazard Codes of Rhodamine B (CAS NO.81-88-9):?HarmfulXn,Xi,FlammableF
Risk Statements: 22-41-68-67-36-11
R22: Harmful if swallowed.?
R41: Risk of serious damage to the eyes.?
R68: Possible risk of irreversible effects.?
R67: Vapours may cause drowsiness and dizziness.?
R36: Irritating to eyes.?
R11: Highly flammable.
Safety Statements: 7-16-24/25-26-36/37/39?
S7: Keep container tightly closed.?
S16: Keep away from sources of ignition.?
S24/25: Avoid contact with skin and eyes.?
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.?
S36/37/39: Wear suitable protective clothing, gloves and eye/face protection.
WGK Germany: 2
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