| Identification | Back Directory | [Name]
1-(4-ISOTHIOCYANATOBENZYL)ETHYLENEDIAMINE-N,N,N',N'-TETRAACETIC ACID | [CAS]
105394-74-9 | [Synonyms]
Tetraac.acid
Isothiocyanobenzyl-Edta
ISOTHIOCYANATOBENZYL-EDTA
ISOTHIOCYANOBENZYL-EDTA(ITCBE)
1-(4-Isothiocyanatobenzyl)ethylenediamine
1-(4-isothiocyanatobenzyl)ethylenedia-mine-tetraac. acid
1-(4-ISOTHIOCYANATOBENZYL)ETHYLENEDIAMINE-N,N,N',N'-TETRAACETIC ACID
1-(4-ISOTHIOCYANATOBENZYL)ETHYLENEDIAMINE-N,N,N',N'-TETRAACETIC ACID
1-(4-Isothiocyanatobenzyl)ethylenediamine-N,N,N',N'-tetraacetic acid ~90% (HPLC)
Glycine, N,N'-[1-[(4-isothiocyanatophenyl)methyl]-1,2-ethanediyl]bis[N-(carboxymethyl)-
2-[[2-[bis(carboxymethyl)amino]-3-(4-isothiocyanatophenyl)propyl]-(carboxymethyl)amino]acetic acid | [Molecular Formula]
C18H21N3O8S | [MDL Number]
MFCD00236411 | [MOL File]
105394-74-9.mol | [Molecular Weight]
439.44 |
| Chemical Properties | Back Directory | [Boiling point ]
765.3±60.0 °C(Predicted) | [density ]
1.43±0.1 g/cm3(Predicted) | [storage temp. ]
−20°C | [pka]
1.78±0.10(Predicted) | [BRN ]
8363400 | [InChI]
1S/C18H21N3O8S/c22-15(23)7-20(8-16(24)25)6-14(21(9-17(26)27)10-18(28)29)5-12-1-3-13(4-2-12)19-11-30/h1-4,14H,5-10H2,(H,22,23)(H,24,25)(H,26,27)(H,28,29) | [InChIKey]
VHMWJVAFPCGUTJ-UHFFFAOYSA-N | [SMILES]
OC(=O)CN(CC(Cc1ccc(cc1)N=C=S)N(CC(O)=O)CC(O)=O)CC(O)=O |
| Safety Data | Back Directory | [Hazard Codes ]
Xi | [Risk Statements ]
36/37/38 | [Safety Statements ]
26-36 | [WGK Germany ]
3 | [F ]
10 | [Storage Class]
11 - Combustible Solids | [Hazard Classifications]
Eye Irrit. 2
Skin Irrit. 2
STOT SE 3 |
| Hazard Information | Back Directory | [Uses]
Isothiocyanatobenzyl-EDTA is a bifunctional chelator used in bioconjugation chemistry to label primary amine containing molecules and proteins preferentially at their N-terminals. |
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