기본 정보
- CAS
53053-08-0- 표준 SMILES
[N-]=[N+]=Nc1ccc(C(=O)ON2C(=O)CCC2=O)cc1- InChIKey
LWAVGNJLLQSNNN-UHFFFAOYSA-N- 분자식
- C11H8N4O4
- 평균 분자량
- 260.21 g/mol
- 단동위원소 질량
- 260.05455475
이름 및 식별자
- 우선 이름
- Hydroxysuccinimidyl-4-azidobenzoate
- IUPAC
- (2,5-dioxopyrrolidin-1-yl) 4-azidobenzoate
- 영어명
- N-Hydroxysuccinimidyl-4-azidobenzoate
- 분자식
- C11H8N4O4
- 분자량
- 260.21
이름 및 동의어
이름 더 보기
데이터베이스 식별자
- CAS
53053-08-0- PubChem CID
- 122153
- DTXSID
DTXSID40201094- UNII
- 8ZXQ80NJ3B
- EC Number
- 892-311-0
- Nikkaji
- J749.962K
물성
구조 계산 물성
- XLogP
- 1.8
- 극성 표면적
- 78 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 6
- 회전 가능 결합 수
- 4
- 무거운 원자 수
- 19
- 형식 전하
- 0
- 복잡도
- 434
물리화학적 성질
- 녹는점
- 171 · 171-172°C
- 저장 조건
- 20 °C · −20°C
- 용해도
- 50 mg/mL · 클로로포름: 50mg/mL
- 물리적 상태
- 가루
- 색상
- Off-white to yellow
안전 및 규제
GHS 분류
GHS Classification
Danger
H241 (50%): Heating may cause a fire or explosion [Danger Self-reactive substances and mixtures; Organic peroxides];H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation];H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation];H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation];H372 (100%): Causes damage to organs through prolonged or repeated exposure [Danger Specific target organ toxicity, repeated exposure]
P210, P234, P235, P240, P260, P261, P264, P264+P265, P270, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P370+P380+P375[+P378], P403, P403+P233, P405, P410, P411, P420, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 2 reports by companies from 2 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
안전 데이터
- wgk
- 3
- HS 번호
- 2928009090
화학 및 산업
약리 정보
MeSH Pharmacological Classification
Analogs of those substrates or compounds which bind naturally at the active sites of proteins, enzymes, antibodies, steroids, or physiological receptors. These analogs form a stable covalent bond at the binding site, thereby acting as inhibitors of the proteins or steroids.
Reagents with two reactive groups, usually at opposite ends of the molecule, that are capable of reacting with and thereby forming bridges between side chains of amino acids in proteins; the locations of naturally reactive areas within proteins can thereby be identified; may also be used for other macromolecules, like glycoproteins, nucleic acids, or other.
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