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Xanthylium, 3,6-bis(diethylamino)-9-[2-(ethoxycarbonyl)phenyl]-, perchlorate (1:1)

HCID 65205
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Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
23857-69-4
Standard SMILES
CCOC(=O)c1ccccc1-c1c2ccc(=[N+](CC)CC)cc-2oc2cc(N(CC)CC)ccc12.[O-][Cl+3]([O-])([O-])[O-]
InChIKey
KEPZSONXOSOCGC-UHFFFAOYSA-M
Molecular formula
C30H35ClN2O7
Average molar mass
571.1 g/mol
Monoisotopic mass
570.2132792

Names & identifiers

Preferred name
Xanthylium, 3,6-bis(diethylamino)-9-[2-(ethoxycarbonyl)phenyl]-, perchlorate (1:1)
IUPAC
[6-(diethylamino)-9-(2-ethoxycarbonylphenyl)xanthen-3-ylidene]-diethylazanium perchlorate
English name
Rhodamine 3b perchlorate
Molecular formula
C30H35ClN2O7
Molecular weight
571.07

Names & synonyms

Xanthylium, 3,6-bis(diethylamino)-9-(2-(ethoxycarbonyl)phenyl)-, perchlorateXanthylium, 3,6-bis(diethylamino)-9-[2-(ethoxycarbonyl)phenyl]-, perchlorateDTXSID2066937Xanthylium, 3,6-bis(diethylamino)-9-(2-(ethoxycarbonyl)phenyl)-, perchlorate (1:1)Xanthylium, 3,6-bis(diethylamino)-9-[2-(ethoxycarbonyl)phenyl]-, perchlorate (1:1)RefChem:195196DTXCID703695323857-69-4Rhodamine 3B (perchlorate)orb2565359SCHEMBL9638625KEPZSONXOSOCGC-UHFFFAOYSA-M
Show more names
Rhodamine 3b perchlorateN-[6-(diethylamino)-9-[2-(ethoxycarbonyl)phenyl]-3H-xanthen-3-ylidene]-N-ethyl-ethanaminium perchlorate
HY-D1747CS-0652873T87325[6-(diethylamino)-9-(2-ethoxycarbonylphenyl)xanthen-3-ylidene]-diethylazanium;perchlorate3,6-Bis(diethylamino)-9-[2-(ethoxycarbonyl)phenyl]xanthen-10-ium perchlorate

Database identifiers

Properties

Computed structural properties

Topological polar surface area
116 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
8
Rotatable bonds
9
Heavy atoms
40
Formal charge
0
Complexity
937

Physicochemical properties

Melting point
181 °C · 181°C
Appearance
Red Green Crystalline Solid
ex/em
557 nm; · λex 557 nm; λem 577 nm in dichloromethane
EPA Substance Registry System
3 · Xanthylium, 3,6-bis(diethylamino)-9-[2-(ethoxycarbonyl)phenyl]-, perchlorate (23857-69-4)
TSCA
TSCA listed

Safety & regulation

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

Safety data

tsca
TSCA listed

Chemistry & industry

Uses & manufacturing

General Manufacturing InformationXanthylium, 3,6-bis(diethylamino)-9-[2-(ethoxycarbonyl)phenyl]-, perchlorate (1:1): INACTIVE

Applications

DescriptionRhodamine 3B Perchlorate is a laser dye, which is insoluble in water.

UsesRhodamine 3B perchlorate is a laser dye,

Suppliers1 total

广州市海珠区正鸿商行020-82550624 13016020539 · [email protected]

Related reactions

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Compound notes

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On this pageBasic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
CAS
23857-69-4
PubChem CID
65205
DTXSID
DTXSID2066937