에틸O-메시틸설포닐아세토하이드록사메이트

Ethyl N-[[(2,4,6-trimethylphenyl)sulfonyl]oxy]ethanimidate

HCID 2724212

노트 반응

부분 구조 검색 유사 구조 찾기

기본 정보

CAS: 38202-27-6
표준 SMILES: CCOC(C)=NOS(=O)(=O)c1c(C)cc(C)cc1C
InChIKey: KQCBSWBQAXTILK-UHFFFAOYSA-N
분자식: C13H19NO4S
평균 분자량: 285.36 g/mol
단동위원소 질량: 285.10347909

이름 및 식별자

우선 이름: Ethyl N-[[(2,4,6-trimethylphenyl)sulfonyl]oxy]ethanimidate
IUPAC: ethyl N-(2,4,6-trimethylphenyl)sulfonyloxyethanimidate
현지명: 에틸O-메시틸설포닐아세토하이드록사메이트
영어명: Ethyl O-mesitylsulfonylacetohydroxamate
분자식: C13H19NO4S
분자량: 285.36

이름 및 동의어

38202-27-6Ethyl N-[[(2,4,6-trimethylphenyl)sulfonyl]oxy]ethanimidateEthyl N-(((2,4,6-trimethylphenyl)sulfonyl)oxy)ethanimidateRefChem:344897Ethyl O-MesitylsulfonylacetohydroxamateEthyl N-(mesitylsulfonyl)oxyacetimidateethyl N-(2,4,6-trimethylphenyl)sulfonyloxyethanimidateEthanimidic acid, N-[[(2,4,6-trimethylphenyl)sulfonyl]oxy]-, ethyl esterSCHEMBL1936771KQCBSWBQAXTILK-UHFFFAOYSA-NDTXSID501192356Ethyl N-mesitylsulfonyloxyacetimidate

이름 더 보기

에틸O-메시틸설포닐아세토하이드록사메이트ethyl (1E)-N-(2,4,6-trimethylphenyl)sulfonyloxyethanimidate(E)-ethyl N-(Mesitylsulfonyl)oxyacetiMidateethyl (Z)-N-((mesitylsulfonyl)oxy)acetimidateEthyl O-(2-mesitylenesulfonyl)acetohydroxamateEthyl O-mesitylsulfoethyl O-methylsulphonylacetohydroxamateEthyl O-methylsulfonylacetohydroxamate.Ethyl o-(mesitylsulfonyl)acetohydroximate

AKOS028108720NS00056048Ethyl N-[(2,4,6-trimethylbenzene-1-sulfonyl)oxy]ethanimidate

데이터베이스 식별자

CAS: 38202-27-6
PubChem CID: 2724212
DTXSID: DTXSID501192356
EC Number: 253-825-5

물성

구조 계산 물성

XLogP: 3.3
극성 표면적: 73.3 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 5
회전 가능 결합 수: 5
무거운 원자 수: 19
형식 전하: 0
복잡도: 401

물리화학적 성질

녹는점: 54 · 54-56 °C (lit.) 54-58 °C
끓는 점: 381.7 · 381.7±52.0 °C(Predicted)
밀도: 1.2483 · 1.2483 (rough estimate)
굴절률: 1.68 · 1.6800 (estimate)
저장 조건: 2 · 2-8°C
물리적 상태: powder to crystal
색상: 흰색에서 거의 흰색
수용성: 불용성
BRN: 2144156 · 2144156
InChI: InChI=1S/C13H19NO4S/c1-6-17-12(5)14-18-19(15,16)13-10(3)7-9(2)8-11(13)4/h7-8H,6H2,1-5H3
InChIKey: KQCBSWBQAXTILK-UHFFFAOYSA-N
SMILES: C(=NOS(C1=C(C)C=C(C)C=C1C)(=O)=O)(OCC)C

화학적 성질

white to light yellow crystalline powder

안전 및 규제

GHS 분류

GHS Classification · 5건

This chemical does not meet GHS hazard criteria for 66.7% (2 of 3) of all reports.

Warning

H315 (33.3%): Causes skin irritation [Warning Skin corrosion/irritation]

P264, P264+P265, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, and P362+P364 (click each P-code to see the statement)

Aggregated GHS information provided per 3 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Hazard Classes and CategoriesSkin Irrit. 2 (33.3%)

안전 데이터

wgk: 3
HS 번호: 29252900
safety_code: 24/25
F 고인화성물질: 6-9-21
스토리지 클래스: 11 - Combustible Solids

화학 및 산업

상·하류 제품 정보

상류 원료

하류 제품

O-Mesitylenesulfonylhydroxylamine

공급사100 곳

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]

阿诺西（上海）生物技术有限公司400-1107768 15058188853 · [email protected]

上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]

湖北威德利化学试剂有限公司181-6332-1995 18062128043 · [email protected]

毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]

화합물 노트

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