기본 정보
- CAS
305-53-3- 표준 SMILES
O=C([O-])CI.[Na+]- InChIKey
AGDSCTQQXMDDCV-UHFFFAOYSA-M- 분자식
- C2H2INaO2
- 평균 분자량
- 207.93 g/mol
- 단동위원소 질량
- 207.89972158
개요
Sodium iodoacetate is an organic molecular entity.
이름 및 식별자
- 우선 이름
- Sodium Iodoacetate
- IUPAC
- sodium 2-iodoacetate
- 현지명
- 소듐 아이오도아세테이트
- 영어명
- Iodoacetic acid sodium salt
- 분자식
- C2H2INaO2
- 분자량
- 207.93
이름 및 동의어
sodium iodoacetate305-53-3Iodoacetic acid sodium saltSodium monoiodoacetateACETIC ACID, IODO-, SODIUM SALTIodoacetate, sodium salt07814F2QRIDTXSID0059790monosodium iodoacetateRefChem:183943DTXCID5038208206-165-7
이름 더 보기
소듐아이오도아세테이트아이오도아세트산 나트륨usafek-6279meet standardSODIUM IODACETATESodiumIodoacetate,>98%iodoacetate,sodiumsaltiodoacetate, sodium sal2-iodoacetate(305-53-3)
sodium 2-iodoacetateIodoacetic acid, sodium saltsodium;2-iodoacetateAcetic acid, 2-iodo-, sodium salt (1:1)MFCD00002686iodoacetate (Sodium)sodium,2-iodoacetateCCRIS 9232
데이터베이스 식별자
- CAS
305-53-3- PubChem CID
- 5239
- DTXSID
DTXSID0059790- ChEBI
CHEBI:234594- UNII
- 07814F2QRI
- EC Number
- 206-165-7
- Nikkaji
- J86.217G
물성
구조 계산 물성
- 극성 표면적
- 40.1 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 2
- 회전 가능 결합 수
- 1
- 무거운 원자 수
- 6
- 형식 전하
- 0
- 복잡도
- 46.8
실험 및 물리화학적 성질
Chemical ClassesMetals -> Organic Acids, Metal Salts
Physical DescriptionLight yellow hygroscopic powder; [Sigma-Aldrich MSDS]
물리화학적 성질
- 녹는점
- 208 °C · 208 °C (dec.)(lit.)
- 저장 조건
- -20 °C · -20°C
- 용해도
- 20 °C에서 · 메탄올: 20°C에서 0.1°M, 투명, 무색
- 물리적 상태
- 가루
- 색상
- 연한 노란색에서 황갈색
- 생물학적 소스
- synthetic (organic)
- 수용성
- 100 mg/mL · water: 100mg/mL
- BRN
- 4009322 · 4009322
- InChI
- InChI=1S/C2H3IO2.Na/c3-1-2(4)5;/h1H2,(H,4,5);/q;+1/p-1
- InChIKey
- AGDSCTQQXMDDCV-UHFFFAOYSA-M
- SMILES
- C([O-])(=O)CI.[Na+]
- EPA
- Acetic acid, iodo-, sodium salt (305-53-3)
- Absorption
- 335 nm · cut-off at 335nm in methanol at 0.1M
화학적 성질
light yellow to yellow-brown powder
안전 및 규제
GHS 분류
GHS Classification
Danger
H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P316, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 41 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
유해성 정보
Regulatory Information
Chemical: Acetic acid, iodo-, sodium salt
Acetic acid, iodo-, sodium salt: Does not have an individual approval but may be used under an appropriate group standard
Hazards SummaryAn irritant that may cause serious eye injury; Toxic by ingestion; [Sigma-Aldrich MSDS] See Iodoacetic acid.
Hazard Classes and CategoriesAcute Tox. 3 (100%)
안전 데이터
- wgk
- 3
- tsca
- TSCA listed
- rtecs
- AI3675000
- ridadr
- UN 2811 6.1/PG 1
- HS 번호
- 29159000
- risk_code
- 25-37/38-41-20/21/22-36/37/38
- hazard_code
- T,Xn
- safety_code
- 26-39-45-36-36/37/39-22
- 포장분류
- III
- 위험 등급
- 6.1(b)
- F 고인화성물질
- 3-8-10
- Hazard Classifications
- Acute Tox. 3 OralEye Dam. 1Skin Corr. 1B
- 스토리지 클래스
- 6.1A - Combustible acute toxic Cat. 1 and 2very toxic hazardous materials
화학 및 산업
약리 정보
MeSH Pharmacological ClassificationCompounds or agents that combine with an enzyme in such a manner as to prevent the normal substrate-enzyme combination and the catalytic reaction.
용도 및 제조
UsesIodoacetic acid and its salts and derivatives. Iodoacetic acid reacts with cysteine (-SH) groups to form a carboxymethylated protein and is used as an enzyme inhibitor in biochemical research. [ChemIDplus]
General Manufacturing InformationAcetic acid, 2-iodo-, sodium salt (1:1): ACTIVE
응용 분야
용도Analytical reagent.
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