기본 정보
- CAS
78-73-9- 표준 SMILES
C[N+](C)(C)CCO.O=C([O-])O- InChIKey
DQKGOGJIOHUEGK-UHFFFAOYSA-M- 분자식
- C5H14NO.CHO3
- 평균 분자량
- 165.19 g/mol
- 단동위원소 질량
- 165.10010796
개요
See also: Bicarbonate Ion (has active moiety).
이름 및 식별자
- 우선 이름
- Choline bicarbonate
- IUPAC
- hydrogen carbonate;2-hydroxyethyl(trimethyl)azanium
- 현지명
- 클로린 하이드로젠 카보네이트
- 영어명
- Choline bicarbonate
- 분자식
- C6H15NO4
- 분자량
- 165.19
이름 및 동의어
CHOLINE BICARBONATE78-73-9Choline carbonate (1:1)Choline, hydrogen carbonateUNII-V23DAH2UHH(2-Hydroxyethyl)trimethylammonium bicarbonateV23DAH2UHHHydroxyethyltrimethylammonium bicarbonateEINECS 201-137-0NSC 163321Choline, carbonate (1:1) (salt)EC 201-137-0
이름 더 보기
클로린하이드로젠카보네이트콜린중탄산염DK910CHOLINE BICARBONATE SALTCHOLINE HYDROGEN CARBONATEcholine bicarbonate solutionCHOLINEBICARBONATE,75%SOLUTIONCholine bicarbonate-13C solution2-Methyl-28-nitrobenzyl&chlorideCholine bicarbonate~80% in waterCHOLINE BICARBONATE APPROX. 80% AQUE
NSC-163321DTXSID9051246Ethanaminium, 2-hydroxy-N,N,N-trimethyl-, carbonate (1:1) (salt)Choline, carbonate (1:1) (salt) (8CI)RefChem:125747DTXCID8029868(2Hydroxyethyl)trimethylammonium bicarbonate2HydroxyN,N,Ntrimethylethanaminium hydrogen carbonate
데이터베이스 식별자
- CAS
물성
구조 계산 물성
- 극성 표면적
- 80.6 Ų
- 수소 결합 공여자 수
- 2
- 수소 결합 수용자 수
- 4
- 회전 가능 결합 수
- 2
- 무거운 원자 수
- 11
- 형식 전하
- 0
- 복잡도
- 71.3
실험 및 물리화학적 성질
Chemical ClassesBiological Agents -> Vitamins and Derivatives
Physical DescriptionSolid; [ECHA REACH Registrations]
물리화학적 성질
- 밀도
- 1.17 g/mL · 1.17 g/mL at 25 °C (lit.)
- 증기압
- 23.904 hPa · 23.904hPa at 25℃
- 굴절률
- 20 · n20/D 1.45
- 저장 조건
- 2 · 2-8°C
- 용해도
- 메탄올(소량으로 용해), 물(수용성)
- 물리적 상태
- 무색 용액
- 수용성
- 750 g/L · 750g/L at 20℃
- InChI
- InChI=1S/C5H14NO.CH2O3/c1-6(2,3)4-5-7;2-1(3)4/h7H,4-5H2,1-3H3;(H2,2,3,4)/q+1;/p-1
- InChIKey
- DQKGOGJIOHUEGK-UHFFFAOYSA-M
- SMILES
- C(CO)[N+](C)(C)C.C(O)([O-])=O
- EPA
- Choline carbonate (1:1) (78-73-9)
화학적 성질
Colorless liquid.Miscible with water.
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS Classification
This chemical does not meet GHS hazard criteria for 62% (111 of 179) of all reports.
Warning
H315 (37.4%): 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 179 reports by companies from 9 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
유해성 정보
Regulatory Information
Chemical: Ethanaminium, 2-hydroxy-N,N,N-trimethyl-, carbonate (1:1) (salt)
Status: Active Update: 16-05-2013 https://echa.europa.eu/registration-dossier/-/registered-dossier/11430
Other Safety InformationEvaluation - Chemicals that are unlikely to require further regulation to manage risks to environment
Hazards SummaryOnly available commercially as an aqueous solution (usually 75%); [ECHA REACH Registrations] 80% aqueous solution: An irritant; [Sigma-Aldrich MSDS] See Choline.
Hazard Classes and CategoriesSkin Irrit. 2 (37.4%)
안전 데이터
- wgk
- 3
- tsca
- TSCA listed
- risk_code
- 36/37/38
- hazard_code
- Xi
- safety_code
- 26-37/39
- Hazard Classifications
- Eye Irrit. 2Skin Irrit. 2STOT SE 3
화학 및 산업
용도 및 제조
Uses
Used to formulate metal surface treatment products (including those for galvanizing and electroplating), non-metal surface treatment products, hydraulic fluids, processing aids (i.e. pH regulators, flocculants, and precipitants), laboratory chemicals, plant protection products, pharmaceuticals, flux coating/core welding and soldering products, and as a clay stabilizer for fracturing in the mining industry; [ECHA REACH Registrations]
Mining [Category: Industry]
General Manufacturing InformationEthanaminium, 2-hydroxy-N,N,N-trimethyl-, carbonate (1:1): ACTIVE
응용 분야
용도Choline Bicarbonate is compound is used for protein delivery, Alkaline catalyst, intermediate for choline salts and surfactants.
상·하류 제품 정보
상류 원료
공급사87 곳
湖北永阔科技有限公司027-59223108 15972152991 · [email protected]
湖北万得化工有限公司15377098680 15377098680 · [email protected]
Hebei Zhuanglai Chemical Trading Co Ltd+86-16264648883 · [email protected]
Hubei Lidu New Material Technology Co., Ltd+86-19307248857 +86-19307248857 · [email protected]
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