CAS 95407-69-5 4-Methoxy-2,2,6,6-tetramethylpiperidinyl-1-oxy (HCID 125323)

기본 정보

CAS: 95407-69-5
표준 SMILES: COC1CC(C)(C)N([O-])C(C)(C)C1
InChIKey: BGXWUNHAMWRFOR-UHFFFAOYSA-N
분자식: C10H20NO2-
평균 분자량: 186.27 g/mol
단동위원소 질량: 186.14940388

이름 및 식별자

우선 이름: 4-Methoxy-2,2,6,6-tetramethylpiperidinyl-1-oxy
IUPAC: 4-methoxy-2,2,6,6-tetramethyl-1-oxidopiperidine
현지명: 4-METHOXY-2,2,6,6-테트라메틸렌피페리딘1-OXYL
영어명: 4-Methoxy-2,2,6,6-tetramethylpiperidine 1-oxyl
분자식: C10H20NO2
분자량: 186.27

이름 및 동의어

4-Methoxy-2,2,6,6-tetramethylpiperidinyl-1-oxyRefChem:995664-methoxy-2,2,6,6-tetramethyl-1-oxidopiperidine4-methoxy-2,2,6,6-tetramethylpiperidin-1-olateDTXSID10915010BGXWUNHAMWRFOR-UHFFFAOYSA-NNS001229554-Methoxy-2,2,6,6-tetramethylpiperidine 1-Oxyl Free Radical [Catalyst for Oxidation]4-METHOXY-2,2,6,6-테트라메틸렌피페리딘1-OXYL4-METHOXY-TEMPO4-Methoxy-TEMPO 97%4-METHOXY-TEMPO, FREE RADICAL

이름 더 보기

Methoxytetramethylpiperidineoxyl4-Methoxy-TEMPO, free radical, 98+%4-Methoxy-2,2,6,6-tetramethyl-1-piperidinyloxy4-Methoxy-2,2,6,6-tetramethylpiperidine 1-oxyl[4-Methoxy-2,2,6,6-tetramethylpiperidinooxy]radical(2,2,6,6-Tetramethyl-4-methoxypiperidinooxy)radical

데이터베이스 식별자

CAS: 95407-69-5
PubChem CID: 125323
DTXSID: DTXSID10915010
Nikkaji: J3.572.950J

물성

구조 계산 물성

XLogP: 1.3
극성 표면적: 35.5 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 3
회전 가능 결합 수: 1
무거운 원자 수: 13
형식 전하: -1
복잡도: 171

물리화학적 성질

녹는점: 40.5 · 40.5-44 °C (lit.)
저장 조건: 2 · 2-8°C
물리적 상태: powder to crystal
색상: Orange to Amber to Dark red
BRN: 4740399 · 4740399
InChI: 1S/C10H20NO2/c1-9(2)6-8(13-5)7-10(3,4)11(9)12/h8H,6-7H2,1-5H3
InChIKey: SFXHWRCRQNGVLJ-UHFFFAOYSA-N
SMILES: COC1CC(C)(C)N([O])C(C)(C)C1

안전 및 규제

안전 데이터

wgk: 3
HS 번호: 2933399990
risk_code: 36/37/38
hazard_code: Xi
safety_code: 26-36
스토리지 클래스: 11 - Combustible Solids

화학 및 산업

응용 분야 · 2건

용도4-Methoxy-TEMPO may be employed as catalyst for the synthesis of 2-substituted benzoxazoles, via aerobic oxidation reaction.

일반 설명4-Methoxy-TEMPO (4-methoxy-2,2,6,6-tetramethyl-1-piperidinyloxy) is an aminoxyl free radical commonly employed for the oxidation reaction of alcohols (primary/secondary). It has been proposed as hindered amine light stabiliser (HALS) model compound. Its reaction with irradiated dilute aqueous suspensions of photocatalytic nanoparticulate titanium dioxide was investigated by electron spin resonance (ESR) and electrospray ionization mass-spectrometry (ESI-MS).