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Home> Hot Product Listed X   > Xanthylium,9-[2-carboxy-5-[[(2,5-dioxo-1-pyrrolidinyl)oxy]carbonyl]phenyl]-3,6-bis(dimethylamino)-,i...
947191-19-7 structure

Xanthylium,9-[2-carboxy-5-[[(2,5-dioxo-1-pyrrolidinyl)oxy]carbonyl]phenyl]-3,6-bis(dimethylamino)-,inner salt

Iupac Name:ethyl 5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-indazole-3-carboxylate
CAS No.:947191-19-7
Molecular Weight:316.164
Molecular Formula:C9H12O (isomer)
Names and Identifiers
Synonyms

6-CarboxytetramethylrhodamineN-succinimidyl ester 6-TAMRA-NHS ester 6-TAMRA-SE

Inchi
InChI=1S/C16H21BN2O4/c1-6-21-14(20)13-11-9-10(7-8-12(11)18-19-13)17-22-15(2,3)16(4,5)23-17/h7-9H,6H2,1-5H3,(H,18,19)
InChkey
WGBOIRLHBDFLAS-UHFFFAOYSA-N
Canonical Smiles
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)NN=C3C(=O)OCC
Properties
Solubility
DMF:soluble
Storage temp
−20°C
Safety and Handling
Safety

Safty information about 6-Carboxytetramethylrhodamine succinimidyl ester (CAS NO.150810-69-8) is:
Hazard Codes: IrritantXi
Risk Statements: 36/37/38 
R36/37/38:Irritating to eyes, respiratory system and skin.
Safety Statements: 26-36 
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. 
S36:Wear suitable protective clothing.
WGK Germany: 3
F: 8-10-21

Specification

 6-Carboxytetramethylrhodamine succinimidyl ester , its cas register number is 150810-69-8. It also can be called 6-Carboxytetramethylrhodamine, Succinimide Ester ; 6-Carboxytetramethylrhodamine, Succinimidyl Ester ; 6-Tamra Se .

Computational chemical data
  • Molecular Weight:316.164g/mol
  • Molecular Formula:C9H12O
  • Compound Is Canonicalized:True
  • Exact Mass:316.159
  • Monoisotopic Mass:316.159
  • Complexity:455
  • Rotatable Bond Count:4
  • Hydrogen Bond Donor Count:1
  • Hydrogen Bond Acceptor Count:5
  • Topological Polar Surface Area:73.4A^2
  • Heavy Atom Count:23
  • Defined Atom Stereocenter Count:0
  • Undefined Atom Stereocenter Count:0
  • Defined Bond Stereocenter Count:0
  • Undefined Bond Stereocenter Count:0
  • Isotope Atom Count:0
  • Covalently-Bonded Unit Count:1
  • CACTVS Substructure Key Fingerprint: AAADceJ7OAAAAAAAAAAAAAAAAAAAAWJAAAAwAAAAAAAAAFgB8AAoHgAYAAAADEyhngIyyPBjBACq AyTySASSBAAmAgAYuSGwbNgLJrKA9dmDtQBk2AEI6Qe8yKCOgAAAAAACAAAAAAAAAAQAAAAAAAAA AA==
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