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Xanthylium, 9-(2-(ethoxycarbonyl)phenyl)-3,6-bis(ethylamino)-2,7-dimethyl-, perchlorate (1:1)

HCID 65202
NotesReactions
Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
13161-28-9
Standard SMILES
CCNc1cc2oc3cc(=[NH+]CC)c(C)cc-3c(-c3ccccc3C(=O)OCC)c2cc1C.[O-][Cl+3]([O-])([O-])[O-]
InChIKey
HDAFVOZRAUFNQH-WTKGSRSZSA-N
Molecular formula
C28H31ClN2O7
Average molar mass
543 g/mol
Monoisotopic mass
542.181979

Names & identifiers

Preferred name
Xanthylium, 9-(2-(ethoxycarbonyl)phenyl)-3,6-bis(ethylamino)-2,7-dimethyl-, perchlorate (1:1)
IUPAC
[9-(2-ethoxycarbonylphenyl)-6-(ethylamino)-2,7-dimethylxanthen-3-ylidene]-ethylazanium perchlorate
English name
RHODAMINE 6G PERCHLORATE
Molecular formula
C28H31ClN2O7
Molecular weight
543.01

Names & synonyms

Xanthylium, 9-[2-(ethoxycarbonyl)phenyl]-3,6-bis(ethylamino)-2,7-dimethyl-, perchlorate (1:1)EINECS 236-099-49-(2-(Ethoxycarbonyl)phenyl)-3,6-bis(ethylamino)-2,7-dimethylxanthylium perchlorateXanthylium, 9-(2-(ethoxycarbonyl)phenyl)-3,6-bis(ethylamino)-2,7-dimethyl-, perchlorateXanthylium, 9-[2-(ethoxycarbonyl)phenyl]-3,6-bis(ethylamino)-2,7-dimethyl-, perchlorateXanthylium, 9-(2-(ethoxycarbonyl)phenyl)-3,6-bis(ethylamino)-2,7-dimethyl-, perchlorate (1:1)9-[2-(ethoxycarbonyl)phenyl]-3,6-bis(ethylamino)-2,7-dimethylxanthylium perchlorateRefChem:902301236-099-413161-28-9Rhodamine 6G perchlorateorb2938886
Show more names
LC 5901RHODAMINE 590 PERCHLORATEExciton Rhodamine 590 PerchlorateRHODAMINE 6G PERCHLORATE (LASER DYE)Rhodamine 6G perchlorate Dye content 99 %Rhodamine 6G perchlorate, laser grade, 99%Rhodamine 6G perchlorate,99%,pure,laser gradeRhodamine 6G perchlorate, laser grade, pure, 99%

Properties

Computed structural properties

Topological polar surface area
136 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
8
Rotatable bonds
7
Heavy atoms
38
Formal charge
0
Complexity
918

Physicochemical properties

Melting point
263 · 263-265 °C
Density
1.1631 · 1.1631 (rough estimate)
refractive index
1.6 · 1.6000 (estimate)
form
Crystalline Powder To Crystals
color
Pink-redto red
λmax
528 nm · 528 nm
InChIKey
HDAFVOZRAUFNQH-WTKGSRSZSA-N
SMILES
OCl(=O)(=O)=O.CCNc1cc2OC3=C\C(=N/CC)C(C)=CC3=C(c2cc1C)c4ccccc4C(=O)OCC
EPA Substance Registry System
9 · Xanthylium, 9-[2-(ethoxycarbonyl)phenyl]-3,6-bis(ethylamino)-2,7-dimethyl-, perchlorate (13161-28-9)
UNSPSC Code
12352103 · 12352103
NACRES
23 · NA.23
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
315 · H315-H319-H335
Precautionary statements
261 · P261-P264-P271-P280-P302+P352-P305+P351+P338

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

GHS classification

GHS Classification · 4 items

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 44 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

Safety data

PPE
dust mask type N95 (US), Eyeshields, Gloves
wgk
3
tsca
TSCA listed
hs_code
32041300
risk_code
36/37/38-22
Signal word
Warning
Symbol(GHS)
GHS07
hazard_code
Xn,Xi
safety_code
37/39-26-36
Storage Class
11 - Combustible Solids
target organs
Respiratory system
Hazard statements
H315-H319-H335
Hazard Classifications
Eye Irrit. 2Skin Irrit. 2STOT SE 3
Precautionary statements
P261-P264-P271-P280-P302+P352-P305+P351+P338

Chemistry & industry

Uses & manufacturing

General Manufacturing InformationXanthylium, 9-[2-(ethoxycarbonyl)phenyl]-3,6-bis(ethylamino)-2,7-dimethyl-, perchlorate (1:1): INACTIVE
Applications · 3 items

DescriptionRhodamine 6G Perchlorate is a profoundly remarkable fluorescent dye widely employed in the domain of biomedical exploration. It has emerged as an invaluable asset in the realms of fluorescence imaging, confocal microscopy, and cellular labeling. Its indubitably indispensable characteristics render it an exceedingly vital instrument, specifically in the meticulous examination of cancerous cell enclaves, allowing for the discernment and visualization of tumor tissues.

UsesRhodamine 6G perchlorate is a xanthene derivative that can be incorporated with nanomaterials to form a nanocluster, which can be used in biological sensing and imaging applications. It may also be used in the development of solid state laser dye for optics and remote sensing.

General DescriptionRhodamine 6G perchlorate is an amphiphilic organic dye that can have a high quantum yield and a tunability in the range of 550-600 nm. It is used in dye lasers and can also be used in the textile industry.

Suppliers30 total

上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
阿法埃莎(中国)化学有限公司400-6106006 · [email protected]
安耐吉化学&3A(安徽泽升科技股份有限公司)400-0056266 · [email protected]
梯希爱(上海)化工贸易有限公司021-61109150 · [email protected]
江苏艾康生物医药研发有限公司

Related reactions

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Compound notes

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On this pageBasic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
ethyl 2-[(3Z)-6-(ethylamino)-3-(ethylimino)-2,7-dimethyl-3H-xanthen-9-yl]benzoate
DTXSID4065365WUONMKNUJIXUFL-UHFFFAOYSA-MMFCD00013117MFCD27996904TYD-01800AKOS000813849AS-80217NS00024169

Database identifiers

CAS
13161-28-9
PubChem CID
65202
DTXSID
DTXSID4065365
EC Number
236-099-4
target organs
Respiratory system
PPE
95 · dust mask type N95 (US), Eyeshields, Gloves
Hazard Codes
Xn,Xi
Risk Statements
36 · 36/37/38-22
Safety Statements
37 · 37/39-26-36
WGK Germany
3 · 3
TSCA
TSCA listed
HS Code
32041300 · 32041300
Storage Class
11 · 11 - Combustible Solids
Hazard Classifications
2 Skin · Eye Irrit. 2Skin Irrit. 2STOT SE 3
025-5885952 15955137747 · [email protected]
天津希恩思生化科技有限公司400 638 7771 · [email protected]
赛默飞世尔科技(中国)有限公司800-810-5118 · [email protected]
天津普西唐生物医药科技有限公司010-60605840 · [email protected]
陕西缔都医药化工有限公司029-81024372 17792795018 · [email protected]
Sigma-Aldrich西格玛奥德里奇(上海)贸易有限公司021-61415566 800-8193336 · [email protected]
上海昕凯医药科技有限公司21-619849051-1 18521059765 · [email protected]
HANGZHOU LEAP CHEM CO., LTD.+86-571-87711850 +86-15355479329 · [email protected]
上海阿拉丁生化科技股份有限公司6206333 13167063860 · [email protected]
天津康利欣科技有限公司18622939839 · [email protected]
上海思言生物科技有限公司021-50908862,442785678,326799392 18721037013 · [email protected]
上海源叶生物科技有限公司18916372613 · [email protected]
上海颖心实验室设备有限公司021-021-59178156 15300768757 · [email protected]
广州市金华大化学试剂有限公司020-84383047 · [email protected]
Shanghai Acmec Biochemical Technology Co., Ltd.+86-18621343501 · [email protected]
上海启乔生物科技有限公司021-37653318 15221675714 · [email protected]
天津希恩思生化科技有限公司400-6387771-6039 18920764717 · [email protected]
上海吉至生化科技有限公司021-4009004166/18616739031 18616739031 · [email protected]
深圳聚合生化科技有限公司+86-400-002-6226 13028896684 · [email protected]
Aladdin Scientific[email protected]
SHANGHAI KEAN TECHNOLOGY CO., LTD.+8613817748580 · [email protected]
BOC Sciences+1-631-485-4226 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
河北品科研生物科技有限公司4000-685-696 18932660197 · [email protected]
上海鼓臣生物技术有限公司021-34675735 19147740836 · [email protected]