Tetraethylammonium p-toluenesulphonate

HCID 101846CAS 733-44-8

기본 정보

표준 SMILES: CC[N+](CC)(CC)CC.Cc1ccc(S(=O)(=O)[O-])cc1
InChIKey: QKFFSWPNFCXGIQ-UHFFFAOYSA-M
분자식: C15H27NO3S
평균 분자량: 301.4 g/mol

이름 및 식별자

우선 이름: Tetraethylammonium p-toluenesulphonate
IUPAC: 4-methylbenzenesulfonate;tetraethylazanium

이름 및 동의어

Tetraethylammonium p-toluenesulfonate733-44-8Tetraethylammonium p-toluenesulphonateEthanaminium, N,N,N-triethyl-, salt with 4-methylbenzenesulfonic acid (1:1)EINECS 211-992-1DTXSID2061062Ethanaminium, N,N,N-triethyl-, 4-methylbenzenesulfonate (1:1)RefChem:897002DTXCID2047517211-992-1Tetraethylammonium 4-methylbenzenesulfonate4-methylbenzenesulfonate;tetraethylazanium

이름 더 보기

MFCD00011831Et4NOTstetraethylammonium tosylateKX8X87A2DQSCHEMBL160282C15H27NO3Sorb2939247TEA 4-methylbenzene-1-sulfonate

데이터베이스 식별자

CAS: 733-44-8
PubChem CID: 101846
DTXSID: DTXSID2061062
UNII: KX8X87A2DQ
EC Number: 211-992-1

물성

구조 계산 물성

극성 표면적: 65.6 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 3
회전 가능 결합 수: 4
무거운 원자 수: 20
형식 전하: 0
복잡도: 240

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 46 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.