4-Isothiocyanato-2,2,6,6-tetramethylpiperidine 1-Oxyl Free Radical

Name: 4-Isothiocyanato-2,2,6,6-tetramethylpiperidine 1-Oxyl Free Radical
SKU: ACM36410818-1
Rating: 5 (1 reviews)

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Catalog NumberACM36410818-1

CAS Number36410-81-8

CategoryOrganic Radicals; Battery Materials

4-Isothiocyanato-2,2,6,6-tetramethylpiperidine 1-Oxyl Free Radical

Synonyms

4-Isothiocyanato-TEMPO Free Radical

Molecular Weight

213.32

Molecular Formula

C10H17N2OS

Canonical SMILES

CC1(CC(CC(N1[O])(C)C)N=C=S)C

InChI

InChI=1S/C10H17N2OS/c1-9(2)5-8(11-7-14)6-10(3,4)12(9)13/h8H,5-6H2,1-4H3

InChI Key

BKENZAFIBRCMKD-UHFFFAOYSA-N

Melting Point

128 °C

Purity

>97.0%(GC)(T)

Appearance

Light yellow to Brown powder to crystal

Storage

Store under inert gas

Complexity

251

Covalently-Bonded Unit Count

Exact Mass

213.106159g/mol

Formal Charge

Hazard Statements

H315 : Causes skin irritation.H319 : Causes serious eye irritation.

Heavy Atom Count

MDL Number

MFCD00010109

MeSH Entry Terms

4-isothiocyanato-2,2,6,6-tetramethylpiperidinooxyl;4-ITC-TEMPO

Monoisotopic Mass

213.106159g/mol

Precautionary Statements

P264 : Wash skin thoroughly after handling.P280 : Wear protective gloves/ eye protection/ face protection.P337 + P313 : If eye irritation persists: Get medical advice/ attention.P305 + P351 + P338 : IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing.P302 + P352 : IF ON SKIN: Wash with plenty of soap and water.P332 + P313 : If skin irritation occurs: Get medical advice/ attention.P362 : Take off contaminated clothing and wash before reuse.

Rotatable Bond Count

Signal Word

Warning

XLogP3

2.9

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