기본 정보
- CAS
84824-76-0- 표준 SMILES
S=C(S)c1cnc[nH]1- InChIKey
RAUHREXYGRKIOJ-UHFFFAOYSA-N- 분자식
- C4H4N2S2
- 평균 분자량
- 144.2 g/mol
- 단동위원소 질량
- 143.98159048
이름 및 식별자
- 우선 이름
- 1H-Imidazole-4-carbodithioic acid
- IUPAC
- 1H-imidazole-5-carbodithioic acid
- 현지명
- 4-이미다졸디티오카르복시산
- 영어명
- 4(5)-Imidazoledithiocarboxylic acid
- 분자식
- C4H4N2S2
- 분자량
- 144.22
이름 및 동의어
1H-Imidazole-4-carbodithioic acid84824-76-01H-imidazole-5-carbodithioic acidEINECS 284-227-2DTXSID60233877RefChem:438412DTXCID90156368284-227-24-Imidazoledithiocarboxylic acid4(5)-Imidazoledithiocarboxylic acidMFCD03428062SCHEMBL669943
이름 더 보기
4-이미다졸디티오카르복시산4(5)-이미다졸디티카르복실산4-IMidazoledithiocarboxylate1H-IMidazol-4-carbodithioic acidImidazole-4-dithiocarboxylicacid1H-iidazole-4-carbodithioic acid1H-Imidazol-5-carbodithioic acid
SCHEMBL129979505-Imidazoledithiocarboxylic acid1H-Imidazole-4-carbodithioiSCHEMBL7875404imidazol-5-ylmethanedithioic acid1H-Imidazole-4-carbodithioicacidRAUHREXYGRKIOJ-UHFFFAOYSA-N4-(5)-imidazoledithiocarboxylic acid
데이터베이스 식별자
- CAS
84824-76-0- PubChem CID
- 3020150
- DTXSID
DTXSID60233877- EC Number
- 284-227-2
- Nikkaji
- J309.483I
물성
구조 계산 물성
- XLogP
- 1
- 극성 표면적
- 61.8 Ų
- 수소 결합 공여자 수
- 2
- 수소 결합 수용자 수
- 3
- 회전 가능 결합 수
- 1
- 무거운 원자 수
- 8
- 형식 전하
- 0
- 복잡도
- 104
물리화학적 성질
- 녹는점
- 145 °C · 145 °C (dec.)(lit.)
- 끓는 점
- 369.1 · 369.1±34.0 °C(Predicted)
- 밀도
- 1.472 · 1.472±0.06 g/cm3(Predicted)
- 산도 계수 (pKa)
- 1.99 · 1.99±0.63(Predicted)
- InChI
- InChI=1S/C4H4N2S2/c7-4(8)3-1-5-2-6-3/h1-2H,(H,5,6)(H,7,8)
- InChIKey
- RAUHREXYGRKIOJ-UHFFFAOYSA-N
- SMILES
- C1NC(C(=S)S)=CN=1
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]
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 39 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
유해성 정보
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
안전 데이터
- wgk
- 3
- risk_code
- 36/37/38
- hazard_code
- Xi
- safety_code
- 26-36
- Hazard Classifications
- Eye Irrit. 2Skin Irrit. 2STOT SE 3
- 스토리지 클래스
- 11 - Combustible Solids
화학 및 산업
응용 분야
용도4-Imidazoledithiocarboxylic acid (4(5)-imidazoledithiocarboxylic acid, imidazole-4-dithiocarboxylic acid) is suitable for use in the preparation of imidazole functionalized silica with enhanced metal uptake and 3H-imidazole-4-carbodithioic acid 4-vinyl-benzyl ester, a RAFT (reversible addition-fragmentation chain transfer) agent used in the synthesis of highly-branched polymers.It may be used in the synthesis of the following:Nucleophilic fatty acid ligands containing imidazole derivatives.Diorganotin (IV) complexes by reacting with diorganotin (IV) dichlorides.2-(Imidazol-4-yl-4′)benzimidazole by reacting with o-phenylenediamine.
일반 설명4-Imidazoledithiocarboxylic acid is an imidazole derivative.
공급사34 곳
Hebei Chuanghai Biotechnology Co., Ltd+86-17732866630 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
Syntechem Co.,Ltd[email protected]
河南英田生物科技有限公司0370-4053511; 18339993703 · [email protected]
梯希爱（上海）化工贸易有限公司021-61109150 · [email protected]
上海瀚鸿科技股份有限公司021-54306202 13764082696 · [email protected]
武汉丰泰威远科技有限公司+86-27-8746-5837 +86-18627785180 · [email protected]
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