Tetraxetan N-hydroxysuccinimide

Basic Information

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CAS Number

170908-81-3

Molecular Formula

C20H31N5O10

Molecular Weight

501.49 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Surfactants Anionic Surfactants

Laboratory Chemicals Research Chemicals Biochemical Reagents

Basic Physical Properties

SMILES

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C1CC(=O)N(C1=O)OC(=O)CN2CCN(CCN(CCN(CC2)CC(=O)O)CC(=O)O)CC(=O)O

InChI

InChI=1S/C20H31N5O10/c26-15-1-2-16(27)25(15)35-20(34)14-24-9-7-22(12-18(30)31)5-3-21(11-17(28)29)4-6-23(8-10-24)13-19(32)33/h1-14H2,(H,28,29)(H,30,31)(H,32,33)

InChIKey

XSVWFLQICKPQAA-UHFFFAOYSA-N

LogP

-2.9309999999999894

Topological Polar Surface Area

188.54000000000002 Å²

Hydrogen Bond Donor/Acceptor

3 / 15

Complexity

774

Synonyms & References

English

1,4,7,10-Tetraazacyclododecane-1,4,7-triacetic acid,10-[2-[(2,5-dioxo-1-pyrrolidinyl)oxy]-2-oxoethyl]-
1,4,7,10-Tetraazacyclododecane-1,4,7,10-Tetraacetic Acid 1-(2,5-Dioxo-1-Pyrrolidinyl) Ester
DOTA mono-N-hydroxysuccinimide ester
DOTA-NHS ester
DOTA-NHS-ester
DOTA-NHS-ester(B-280)
CS-0101897
PD171045
[4,7-biscarboxymethyl-10-(2,5-dioxopyrrolidin-1-yloxycarbonylmethyl)-1,4,7,10-tetraazacyclododec-1-yl]acetic acid
170908-81-3
DOTA-HS-ster
MS-29307
MFCD23381190
SCHEMBL560792
DOTA-?NHS-?ester
532QWX2588
2,2',2''-(10-(2-(2,5-dioxopyrrolidin-1-yloxy)-2-oxoethyl)-1,4,7,10-tetraazacyclododecane-1,4,7-triyl) triacetic acid
2,2',2''-(10-(2-((2,5-Dioxopyrrolidin-1-yl)oxy)-2-oxoethyl)-1,4,7,10-tetraazacyclododecane-1,4,7-triyl)triaceticacid
AKOS024258634
Tetraxetan N-hydroxysuccinimide
1,4,7,10-Tetraazacyclododecane-1,4,7-triacetic acid, 10-[2-[(2,5-dioxo-1-pyrrolidinyl)oxy]-2-oxoethyl]-
2,2 inverted exclamation mark ,2 inverted exclamation mark inverted exclamation mark -[10-[2-[(2,5-Dioxo-1-pyrrolidinyl)oxy]-2-oxoethyl]-1,4,7,10-tetraazacyclododecane-1,4,7-triyl]triacetic Acid
AT26012
1,4,7,10-Tetraazacyclododecane-1,4,7,10-tetraacetic acid, 1-(2,5-dioxo-1-pyrrolidinyl) ester
2,2',2''-(10-(2-((2,5-Dioxopyrrolidin-1-yl)oxy)-2-oxoethyl)-1,4,7,10-tetraazacyclododecane-1,4,7-triyl)triacetic acid
DA-52668
Q27261050
2-[4,10-bis(carboxymethyl)-7-[2-(2,5-dioxopyrrolidin-1-yl)oxy-2-oxoethyl]-1,4,7,10-tetrazacyclododec-1-yl]acetic acid
SY345140
HY-128890
DOTA-NHS

MDL Number

MFCD23381190

FAQ

What is Tetraxetan N-hydroxysuccinimide (CAS: 170908-81-3)?

Tetraxetan N-hydroxysuccinimide is a chemical compound with the CAS number 170908-81-3. It is an intermediate compound used in organic synthesis, particularly in the activation of carboxylic acids for amide bond formation.

What are the main uses of Tetraxetan N-hydroxysuccinimide (CAS: 170908-81-3)?

Tetraxetan N-hydroxysuccinimide is primarily used as an activation reagent in organic synthesis, particularly in the formation of amide bonds. It is also used in bioconjugation and in the development of pharmaceuticals and materials.

Is Tetraxetan N-hydroxysuccinimide (CAS: 170908-81-3) safe?

Tetraxetan N-hydroxysuccinimide is generally safe when handled with proper protective measures. It is important to follow safety guidelines, including wearing appropriate personal protective equipment (PPE) such as gloves and goggles, and to work in a well-ventilated area. Exposure to skin or eyes should be avoided.

How should Tetraxetan N-hydroxysuccinimide (CAS: 170908-81-3) be stored?

Tetraxetan N-hydroxysuccinimide should be stored in a cool, dry place, away from direct sunlight and sources of heat. It should be kept in a tightly sealed container, preferably made of glass or other suitable non-reactive materials. Storage at temperatures below 25°C is recommended to maintain its stability.