메틸2-트리플루오로메탄술포닐록시-1-나프토에이트

Methyl 2-trifluoromethanesulfonyloxy-1-naphthoate

HCID 11034997

노트 반응

부분 구조 검색 유사 구조 찾기

기본 정보

CAS: 200573-11-1
표준 SMILES: COC(=O)c1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12
InChIKey: BDXDWDCWSCPFEW-UHFFFAOYSA-N
분자식: C13H9F3O5S
평균 분자량: 334.27 g/mol
단동위원소 질량: 334.01227905

이름 및 식별자

우선 이름: Methyl 2-trifluoromethanesulfonyloxy-1-naphthoate
IUPAC: methyl 2-(trifluoromethylsulfonyloxy)naphthalene-1-carboxylate
현지명: 메틸2-트리플루오로메탄술포닐록시-1-나프토에이트
영어명: Methyl 2-trifluoromethanesulfonyloxy-1-naphthoate
분자식: C13H9F3O5S
분자량: 334.27

이름 및 동의어

200573-11-1METHYL 2-TRIFLUOROMETHANESULFONYLOXY-1-NAPHTHOATEDTXSID70452799RefChem:354473DTXCID00403618Methyl 2-(((trifluoromethyl)sulfonyl)oxy)-1-naphthoateMETHYL 2-TRIFLUOROMETHYLSULFONYLOXY-1-NAPHTHOATEMethyl 2-(trifluoromethylsulfonyloxy)naphthalene-1-carboxylatemethyl 2-(trifluoromethanesulfonyloxy)naphthalene-1-carboxylate1-Naphthalenecarboxylic acid, 2-[[(trifluoromethyl)sulfonyl]oxy]-, methyl esterMFCD04039773Methyl 2-[[(Trifluoromethyl)sulfonyl]oxy]-1-naphthoate

이름 더 보기

메틸2-트리플루오로메탄술포닐록시-1-나프토에이트Methyl 2-trifluoromethylsulfonyloxy-1-naphthoate, 98%

SCHEMBL7513949AKOS027320231AS-73694SY492152CS-0361703D97839F753084methyl 2-(trifluoromethylsulfonyloxy)-1-naphthoate

데이터베이스 식별자

CAS: 200573-11-1
PubChem CID: 11034997
DTXSID: DTXSID70452799
EC Number: 681-494-0
Nikkaji: J2.418.786A

물성

구조 계산 물성

XLogP: 3.8
극성 표면적: 78.1 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 8
회전 가능 결합 수: 4
무거운 원자 수: 22
형식 전하: 0
복잡도: 511

물리화학적 성질

녹는점: 41 · 41-43°C
끓는 점: 421.9 · 421.9±45.0 °C(Predicted)
밀도: 1.499 · 1.499±0.06 g/cm3(Predicted)

안전 및 규제

GHS 분류

GHS Classification · 4건

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 4 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.