1-부탄술폰산,4-히드록시-

4-Hydroxy-1-butanesulfonic acid

HCID 96391CAS 26978-64-3

부분 구조 검색 유사 구조 찾기

기본 정보

표준 SMILES: O=S(=O)(O)CCCCO
InChIKey: YEGPVWSPNYPPIK-UHFFFAOYSA-N
분자식: C4H10O4S
평균 분자량: 154.19 g/mol
단동위원소 질량: 154.0299798

이름 및 식별자

우선 이름: 4-Hydroxy-1-butanesulfonic acid
IUPAC: 4-hydroxybutane-1-sulfonic acid
현지명: 1-부탄술폰산,4-히드록시-
영어명: 1-Butanesulfonic acid, 4-hydroxy-
분자식: C4H10O4S
분자량: 154.18

이름 및 동의어

26978-64-34-Hydroxy-1-butanesulfonic acid1-Butanesulfonic acid, 4-hydroxy-NSC 163335UNII-87G94EI36D87G94EI36DNSC 71873NSC-718734-hydroxybutanesulfonic acidDTXSID4067272RefChem:99127DTXCID5037604

이름 더 보기

1-부탄술폰산,4-히드록시-4-hydroxybutylsulfonic acid4-hydroxybutane-sulfonic acid4-hydroxybutane-1-sulfonicaci4-Hydroxybutane-1-sulfonic acid(contains <15%H2O)4-Hydroxy-1-butanesulfonic Acid DISCONTINUED. Please see H953595

608-029-64-hydroxybutane-1-sulfonic acidMFCD28130072Busulfan Impurity 3NSC71873NSC163335SCHEMBL51852SCHEMBL309722

데이터베이스 식별자

CAS: 26978-64-3、31465-25-5
PubChem CID: 96391
DTXSID: DTXSID4067272
ChEMBL: CHEMBL1205974
UNII: 87G94EI36D
EC Number: 608-029-6、928-903-3
Nikkaji: J23.366H

물성

구조 계산 물성

XLogP: -0.9
극성 표면적: 83 Å²
수소 결합 공여자 수: 2
수소 결합 수용자 수: 4
회전 가능 결합 수: 4
무거운 원자 수: 9
형식 전하: 0
복잡도: 142

물리화학적 성질

밀도: 1.393 · 1.393±0.06 g/cm3(Predicted)
저장 조건: 2 · under inert gas (nitrogen or Argon) at 2-8°C
산도 계수 (pKa): 1.74 · 1.74±0.50(Predicted)
InChI: InChI=1S/C4H10O4S/c5-3-1-2-4-9(6,7)8/h5H,1-4H2,(H,6,7,8)
InChIKey: YEGPVWSPNYPPIK-UHFFFAOYSA-N
SMILES: C(S(O)(=O)=O)CCCO
EPA: 1 · 1-Butanesulfonic acid, 4-hydroxy- (26978-64-3)

안전 및 규제

GHS 분류

GHS Classification · 6건

Danger

H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]

P260, P264, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P363, P405, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Danger

H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]

유해성 정보

Regulatory InformationREACH registered substance: 4-hydroxybutane-1-sulfonic acid (EC: 928-903-3)

Hazard Classes and CategoriesSkin Corr. 1B (100%)

안전 데이터

tsca: TSCA listed

화학 및 산업

용도 및 제조

General Manufacturing Information1-Butanesulfonic acid, 4-hydroxy-: INACTIVE

응용 분야

용도4-Hydroxy-1-butanesulfonic Acid is used for the enantiomeric separation of a variety of underivatized anionic and cationic compounds of pharmaceutical interest by capillary electrophoresis.

공급사50 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]

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

广州朗欧生物科技有限公司15876533741 · [email protected]

怀化元研达生物技术有限责任公司18711085600 · [email protected]

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