NIR-641 N-succinimidyl ester

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NIR-641 N-succinimidyl ester

NIR-641 N-succinimidyl ester | 190714-26-2

Catalog Number F02-0028
Category Other Cyanine
Molecular Formula C37H44ClN3O4
Molecular Weight 630.22
Catalog Number Size Price Quantity
F02-0028 -- $--

Product Introduction

NIR-641 N-succinimidyl ester is a potential compound in the biomedical field and plays an integral role in promoting the labeling and imaging of biomolecules. Its unique structure caters for the precise fusion of fluorophores with proteins, DNA, and other important biomolecules, enabling exquisite biological imaging.

Chemical Information

Synonyms 1-Ethyl-1-[5-(N-succinimidyloxycarbonyl)pentyl]-3,3,3,3-tetramethyl-indodicarbocyanine chloride, NIR-641 NHS ester
Purity 98%
IUPAC Name (2,5-dioxopyrrolidin-1-yl) 6-[2-[(1E,3E,5Z)-5-(1-ethyl-3,3-dimethylindol-2-ylidene)penta-1,3-dienyl]-3,3-dimethylindol-1-ium-1-yl]hexanoate;chloride
Canonical SMILES CCN1C2=CC=CC=C2C(C1=CC=CC=CC3=[N+](C4=CC=CC=C4C3(C)C)CCCCCC(=O)ON5C(=O)CCC5=O)(C)C.[Cl-]
InChI InChI=1S/C37H44N3O4.ClH/c1-6-38-29-19-14-12-17-27(29)36(2,3)31(38)21-9-7-10-22-32-37(4,5)28-18-13-15-20-30(28)39(32)26-16-8-11-23-35(43)44-40-33(41)24-25-34(40)42;/h7,9-10,12-15,17-22H,6,8,11,16,23-26H2,1-5H3;1H/q+1;/p-1
InChI Key QNVXMFIPFKQFIP-UHFFFAOYSA-M
  • Product Specification
Storage 24 months after receival at -20°C in the dark. Transportation: at room temperature for up to 3 weeks. Avoid prolonged exposure to light. Desiccate.
Signal Warning
GHS Hazard Statements H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
Precautionary Statement Codes 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 (The corresponding statement to each P-code can be found at the GHS Classification page.)

Computed Properties

Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 12
Exact Mass 629.3020346 g/mol
Monoisotopic Mass 629.3020346 g/mol
Topological Polar Surface Area 69.9Ų
Heavy Atom Count 45
Formal Charge 0
Complexity 1210
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 3
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 2
Compound Is Canonicalized Yes

Patents

Publication NumberTitlePriority Date
CA-2938993-A1 Inspection of dental roots and the endodontic cavity space therein 2014-02-06
EP-3102085-A1 Inspection of dental roots and the endodontic cavity space therein 2014-02-06
JP-2017506947-A Examination of root and its endodontic space 2014-02-06
US-2015216418-A1 Inspection of dental roots and the endodontic cavity space therein 2014-02-06
WO-2015120348-A1 Inspection of dental roots and the endodontic cavity space therein 2014-02-06
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