Tetrabutylammonium hydrogen sulfate (HCID 94433)

이름 및 식별자

우선 이름: Tetrabutylammonium hydrogen sulfate
IUPAC: hydrogen sulfate;tetrabutylazanium
현지명: 테트라뷰틸암모늄 황산
영어명: Tetrabutylammonium hydrogen sulfate
분자식: C16H37NO4S
분자량: 339.53

이름 및 동의어

32503-27-8Tetrabutylammonium hydrogen sulfateTetrabutylammonium hydrogen sulphate1-Butanaminium, N,N,N-tributyl-, sulfate (1:1)RefChem:896764251-068-5Tetrabutylammonium hydrogensulfatetetra-n-Butylammonium hydrogen sulfateTetrabutylammonium bisulfateTetrabutylammonium sulfate (1:1)tetrabutylazanium hydrogen sulfatetetrabutyl ammonium hydrogen sulfate

이름 더 보기

테트라부틸암모늄하이드로겐설페이트테트라뷰틸암모늄황산테트라뷰틸암모늄황산(TETRABUTYLAMMONIUMHYDROGENSULFATE)TBAHSBu4NHSO4IPC-TBA-HSammonium hydrogTETRA-N-BUTYLAMMONIUM HYDROGENSULFATETETRA-N-BUTYLAMMONIUM HYDROGEN SULPHATETetrabutylaminium·sulfuric acid hydrogenanion

Tetrabutyl-ammonium hydrogen sulfatetetrabutylammonium hydrosulfatehydrogen sulfate,tetrabutylazaniumhydrogen sulfate;tetrabutylazaniumtetrabutyl-ammonium hydrogensulfateMFCD00011637TETRABUTYLAMMONIUMHYDROGENSULFATETetrabutylammonium (hydrogensulfate)

데이터베이스 식별자

CAS: 32503-27-8
PubChem CID: 94433
DTXSID: DTXSID4067690
ChEMBL: CHEMBL1079247
UNII: KCU8DU7VEL
EC Number: 251-068-5

물성

구조 계산 물성

극성 표면적: 85.8 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 4
회전 가능 결합 수: 12
무거운 원자 수: 22
형식 전하: 0
복잡도: 192

실험 및 물리화학적 성질

Chemical ClassesNitrogen Compounds -> Quaternary Amines

Physical DescriptionWhite crystalline powder; Hygroscopic; [Alfa Aesar MSDS]

물리화학적 성질

녹는점: 171 · 171-174 °C
끓는 점: 213.3 · 213.3-593.92℃[at 101 325 Pa]
밀도: 1.01 · 1.01
증기압: 0 Pa · 0Pa at 25℃
저장 조건: 30 °C · Store below +30°C.
용해도: 2 O: · H2O: 가용성 10%(w/v), 투명, 무색
물리적 상태: 액체
색상: 흰색에서 베이지색
Specific Gravity: 1.01 · 1.01
냄새: 아민 같은
수소이온지수(pH): 1 · 1-2 (100g/l, H2O, 20℃)
수용성: 녹는
BRN: 3599663 · 3599663
안정성: 안정적이지만 습기에 민감합니다. 강한 산화제와 호환되지 않습니다.
InChI: 1S/C16H36N.H2O4S/c1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4;1-5(2,3)4/h5-16H2,1-4H3;(H2,1,2,3,4)/q+1;/p-1
InChIKey: SHFJWMWCIHQNCP-UHFFFAOYSA-M
SMILES: OS([O-])(=O)=O.CCCC[N+](CCCC)(CCCC)CCCC
LogP: 0.96 at · 0.96 at 25℃
NIST: Tetrabutylammonium hydrogen sulfate(32503-27-8)
EPA: Tetrabutylammonium sulfate (1:1) (32503-27-8)

화학적 성질

It is a stable, hygroscopic, white powder.

안전 및 규제

GHS 분류

GHS Classification · 5건

This chemical does not meet GHS hazard criteria for 0.4% (1 of 231) of reports.

Danger

H302 (90.9%): Harmful if swallowed [Warning Acute toxicity, oral]

P260, P261, P264, P264+P265, P270, P271, P273, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P351+P338, P305+P354+P338, P316, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P363, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 231 reports by companies from 28 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Regulatory Information · 3건

Chemical: 1-Butanaminium, N,N,N-tributyl-, sulfate (1:1)

Status: Active Update: 06-08-2018 https://echa.europa.eu/registration-dossier/-/registered-dossier/18908

Tetrabutylammonium hydrogen sulphate: Does not have an individual approval but may be used under an appropriate group standard

Hazards SummaryA skin and strong eye irritant; Toxic by ingestion; [Alfa Aesar MSDS]

Hazard Classes and CategoriesAcute Tox. 4 (90.9%)

안전 데이터

wgk: 3
tsca: TSCA listed
HS 번호: 29239000
risk_code: 36/37/38-22
hazard_code: Xn,Xi
safety_code: 26-36-37/39
기존화학 물질: KE-34030
F 고인화성물질: 8-10
위험 참고 사항: Irritant
Hazard Classifications: Acute Tox. 4 OralAquatic Chronic 3Eye Dam. 1Skin Corr. 1
스토리지 클래스: 8A - Combustible corrosive hazardous materials

화학 및 산업

약리 정보

MeSH Pharmacological Classification · 1건

Purifying or cleansing agents, usually salts of long-chain aliphatic bases or acids, that exert cleansing (oil-dissolving) and antimicrobial effects through a surface action that depends on possessing both hydrophilic and hydrophobic properties.

용도 및 제조

General Manufacturing Information1-Butanaminium, N,N,N-tributyl-, sulfate (1:1): ACTIVE

응용 분야 · 2건

용도A compound that displays antibacterial properties due to the presence of the quaternary amine and the counter ion. Tetrabutylammonium hydrogen sulfate is an ion pairing reagent that is used in liquid chromatography. It is frequently utilized in the analysis of pharmaceutical compounds and metabolites.

일반 설명Tetrabutylammonium hydrogensulfate, a quaternary ammonium salt, is a phase-transfer reagent. It It serves as solvent for the dissolution of ruthenium(II) complex fac-[Ru(CO)2(H2O)3(C(O)C2H5)][CF3SO3]. It participates as a cocatalyst in the reaction medium for the preparation of alternating polyketones and propionic acid.

제조 방법 · 1건

Tetrabutylammonium hydrogen sulfate can be prepared from tetrabutylammonium azide by treating it with potassium hydrogen sulfate and 10% aqueous sulfuric acid in aqueous medium or from tetrabutylammonium thiocyanate by treating it with relatively concentrated sulfuric acid (70%) at 75 °C.

상·하류 제품 정보

상류 원료

하류 제품

에틸렌트리티오카보네이트 1-(3-(4-Amino-2,6-dichlorophenoxy)propyl)pyrrolidin-2-one 3-Amino-2,2-dimethyl-4-oxo-azetidine-1-sulfonic acid 4,6-다이메틸-피리미딘-2-설포닐플루오라이드 n-부틸 글리시딜 에테르 테트라부틸암모늄아지드 4-메틸-피리미딘-2-설포닐플루오라이드 (S)-(+)-5-(Hydroxymethyl)-2-pyrrolidinone p-toluenesulfonate 1-브로모-4-메톡시부탄 Bis(tetrabutylammonium) sulphate 하이드록시타이로솔 4-Biphenylacetonitrile

공급사50 곳

国药集团化学试剂有限公司86-21-63210123 · [email protected]

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

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

INTATRADE GmbH+49 3493/605464 · [email protected]

爱斯特（成都）生物制药股份有限公司+86-28-85122536 85324413 · [email protected]

연결된 노트

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테트라뷰틸암모늄 황산

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