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6-JOE SE | CAS 113394-23-3

Name: 6-JOE SE
Brand: BOC Sciences
Rating: 5 (1 reviews)

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Product Introduction

6-JOE SE is a conventional fluorophore used in automated DNA sequencing.

Synonyms	6-JOE OSu; Spiro[isobenzofuran-1(3H),9'-[9H]xanthene]-6-carboxylic acid, 4',5'-dichloro-3',6'-dihydroxy-2',7'-dimethoxy-3-oxo-, 2,5-dioxo-1-pyrrolidinyl ester; 2,5-Dioxo-1-pyrrolidinyl 4',5'-dichloro-3',6'-dihydroxy-2',7'-dimethoxy-3-oxospiro[isobenzofuran-1(3H),9'-[9H]xanthene]-6-carboxylate; 2,5-Pyrrolidinedione, 1-[[(4',5'-dichloro-3',6'-dihydroxy-2',7'-dimethoxy-3-oxospiro[isobenzofuran-1(3H),9'-[9H]xanthen]-6-yl)carbonyl]oxy]-; JOE NHS Ester; 2,5-dioxopyrrolidin-1-yl 4',5'-dichloro-3',6'-dihydroxy-2',7'-dimethoxy-3-oxo-3H-spiro[isobenzofuran-1,9'-xanthene]-6-carboxylate
Purity	≥95%
IUPAC Name	(2,5-dioxopyrrolidin-1-yl) 4',5'-dichloro-3',6'-dihydroxy-2',7'-dimethoxy-1-oxospiro[2-benzofuran-3,9'-xanthene]-5-carboxylate
Canonical SMILES	COC1=C(C(=C2C(=C1)C3(C4=CC(=C(C(=C4O2)Cl)O)OC)C5=C(C=CC(=C5)C(=O)ON6C(=O)CCC6=O)C(=O)O3)Cl)O
InChI	InChI=1S/C27H17Cl2NO11/c1-37-15-8-13-23(19(28)21(15)33)39-24-14(9-16(38-2)22(34)20(24)29)27(13)12-7-10(3-4-11(12)26(36)40-27)25(35)41-30-17(31)5-6-18(30)32/h3-4,7-9,33-34H,5-6H2,1-2H3
InChIKey	UUVBVONAGUSCCH-UHFFFAOYSA-N
Density	1.79±0.1 g/cm3
Appearance	Solid
Boiling Point	835.6±75.0°C at 760 mmHg

Storage	Store at -20°C
Signal	Warning
GHSHazardStatements	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
Precautionary Statement Codes	P261, P264, P271, P280, P302+P352, P304+P340, P319, P321, P332+P317, P362+P364, P403+P233, P405, and P501 (The corresponding statement to each P-code can be found at the GHS Classification page.)

XLogP3	3.6
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	11
Rotatable Bond Count	5
Exact Mass	601.0178657 g/mol
Monoisotopic Mass	601.0178657 g/mol
Topological Polar Surface Area	158Å²
Heavy Atom Count	41
Formal Charge	0
Complexity	1060
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Publication Number	Title	Priority Date
WO-2022241209-A1	Compositions and methods for use in identifying or quantifying microorganisms	2021-05-13
WO-2022152777-A1	Storage stable caged haptens	2021-01-15
WO-2022136651-A1	Method for determining active sars-cov-2 infections	2020-12-23
WO-2022119932-A1	Anti-human cd10 antibodies for use in immunohistochemistry (ihc) protocols to diagnose cancer	2020-12-02
EP-4087587-A1	Targeted and localized in vivo delivery of oligonucleotides	2020-01-11

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