2-(4-isothiocyanatobenzyl)-1,4,7-triazacyclononane-1,4,7-triacetic acid

Modify Date: 2025-08-25 21:18:30

2-(4-isothiocyanatobenzyl)-1,4,7-triazacyclononane-1,4,7-triacetic acid Structure
2-(4-isothiocyanatobenzyl)-1,4,7-triazacyclononane-1,4,7-triacetic acid structure
 Common Name 2-(4-isothiocyanatobenzyl)-1,4,7-triazacyclononane-1,4,7-triacetic acid
CAS Number 147597-66-8 Molecular Weight 450.50900
Density 1.37g/cm3 Boiling Point 730.1ºC at 760mmHg
Molecular Formula C20H26N4O6S Melting Point N/A
MSDS N/A Flash Point 395.4ºC

 Names

Name 2-[4,7-bis(carboxymethyl)-5-[(4-isothiocyanatophenyl)methyl]-1,4,7-triazonan-1-yl]acetic acid
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.37g/cm3
Boiling Point 730.1ºC at 760mmHg
Molecular Formula C20H26N4O6S
Molecular Weight 450.50900
Flash Point 395.4ºC
Exact Mass 450.15700
PSA 166.07000
LogP 0.31910
Vapour Pressure 2.24E-22mmHg at 25°C
Index of Refraction 1.634

 Synonyms

NOTA-Bn-NCS
1,4,7-triazacyclononane-1,4,7-triaceticacid
p-SCN-Bn-NOTA
ITC-benzyl-1,4,7-triaza-cyclononane-N,N',N''-triacetic acid
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Chemsrc provides CAS#:147597-66-8 MSDS, density, melting point, boiling point, structure, etc. Its name is 2-(4-isothiocyanatobenzyl)-1,4,7-triazacyclononane-1,4,7-triacetic acid>> amp version: 2-(4-isothiocyanatobenzyl)-1,4,7-triazacyclononane-1,4,7-triacetic acid

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