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기본 정보
- CAS
2921-14-4- 표준 SMILES
Cl.NOCC(=O)O.NOCC(=O)O- InChIKey
KBXIJIPYZKPDRU-UHFFFAOYSA-N- 분자식
- C4H11ClN2O6
- 평균 분자량
- 218.59 g/mol
- 단동위원소 질량
- 218.0305638
이름 및 식별자
- 우선 이름
- Aminooxyacetic acid hemihydrochloride
- IUPAC
- bis(2-aminooxyacetic acid);hydrochloride
- 영어명
- Carboxymethoxylamine hemihydrochloride
- 분자식
- C2H6ClNO3
- 분자량
- 127.53
이름 및 동의어
2921-14-4Aminooxyacetic acid hemihydrochlorideO-(Carboxymethyl)hydroxylamine hemihydrochlorideCarboxymethoxyamine hemihydrochloride5G5QI2GN7AAcetic acid, (aminooxy)-, hydrochloride (2:1)UNII-5G5QI2GN7AAminooxyacetic acid hemichloride(Aminooxy)acetic acid hemihydrochlorideEINECS 220-862-3O-Carboxymethylhydroxylamine hemihydrochlorideNSC 40358
이름 더 보기
AOA hcl (2:1)AOAhemihydrochlorideCarboxymethoxylamine-D2aminooxyaceticacidhemichlorideAMinooxyacetic acid Hydrochloride2-AMINOOXY-ACETICACIHYDROCHLORIDECarboxymethoxyamine·0.5hydrochloride2-aminooxy-aceticacihydrochloride(2:1)(aminooxy)-aceticacihydrochloride(2:1)Aminyloxy-acetic Acid Hemihydrochlorid
NSC 50782NSC 56446AOAA hemihydrochlorideAI3-52279DTXSID50883906Acetic acid, (aminooxy)-, hemihydrochlorideHydroxylamine-O-acetic acid hemihydrochloride(Carboxymethoxy)amine hemihydrochloride
데이터베이스 식별자
- CAS
2921-14-4- PubChem CID
- 2723609
- DTXSID
DTXSID50883906- ChEMBL
CHEMBL1492415- ChEBI
CHEBI:156302- UNII
- 5G5QI2GN7A
- EC Number
- 220-862-3
물성
구조 계산 물성보충 중
- 극성 표면적
- 145 Ų
- 수소 결합 공여자 수
- 5
- 수소 결합 수용자 수
- 8
- 회전 가능 결합 수
- 4
- 무거운 원자 수
- 13
- 형식 전하
- 0
- 복잡도
- 52
물리화학적 성질
- 녹는점
- 156 °C · 156 °C (dec.)(lit.)
- 밀도
- 1.7848 · 1.7848 (rough estimate)
- 굴절률
- 1.65 · 1.6500 (estimate)
- 저장 조건
- 2 · 2-8°C
- 용해도
- 2 mg/mL; · DMF: 2mg/mL; DMSO: 5mg/mL; PBS (pH 7.2): 5mg/mL
- 물리적 상태
- 결정질 분말 또는 결정
- 색상
- 흰색에서 황백색까지
- 생물학적 소스
- synthetic (organic)
- 수용성
- 물에서 분해되다
- BRN
- 3680528 · 3680528
- InChI
- InChI=1S/2C2H5NO3.ClH/c2*3-6-1-2(4)5;/h2*1,3H2,(H,4,5);1H
- InChIKey
- KBXIJIPYZKPDRU-UHFFFAOYSA-N
- SMILES
- C(ON)C(=O)O.C(ON)C(=O)O.Cl
- EPA
- Acetic acid, (aminooxy)-, hydrochloride (2:1) (2921-14-4)
화학적 성질
white to off-white crystalline powder or crystals
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (97.5%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract 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 40 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.
유해성 정보
Hazard Classes and CategoriesSkin Irrit. 2 (100%)；Eye Irrit. 2A (100%)；STOT SE 3 (97.5%)
안전 데이터
- wgk
- 3
- tsca
- TSCA listed
- rtecs
- AF3150000
- HS 번호
- 29280000
- risk_code
- 36/37/38
- hazard_code
- Xi
- safety_code
- 26-36
- F 고인화성물질
- 3
- 스토리지 클래스
- 11 - Combustible Solids
화학 및 산업
용도 및 제조
General Manufacturing InformationAcetic acid, 2-(aminooxy)-, hydrochloride (2:1): ACTIVE
응용 분야
용도Carboxymethoxylamine hemihydrochloride is a bifunctional linking reagent that undergoes condensation with aldehydes and ketones to form oximes. It can also be used as a potent inhibitor of (pyridoxal 5’-phosphate) PLP-dependent β-lyases.
제조 방법
Carboxymethylhydroxylamine hemihydrochloride is obtained by reacting O-carboxymethylacetone oxime with hydrochloric acid.
상·하류 제품 정보
상류 원료
공급사100 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]
成都超九八生物科技有限公司13348960310 13348960310 · [email protected]
武汉欣扬瑞和化学科技有限公司13720274133 · [email protected]
环生美森医药技术（山东）有限公司0531-88762217 18301471076 · [email protected]
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