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기본 정보
- CAS
28784-39-6- 표준 SMILES
CCC(=Cc1sc2ccc3ccccc3c2[n+]1CCCS(=O)(=O)[O-])C=C1Sc2ccc(C)cc2N1CC- InChIKey
BCJMYXULAHGVFY-UHFFFAOYSA-N- 분자식
- C29H30N2O3S3
- 평균 분자량
- 550.771 g/mol
- 단동위원소 질량
- 550.14185582
이름 및 식별자
- 우선 이름
- 3-(2-{2-[(3-Ethyl-5-methyl-1,3-benzothiazol-2(3H)-ylidene)methyl]but-1-en-1-yl}naphtho[1,2-d][1,3]thiazol-1-ium-1-yl)propane-1-sulfonate
- IUPAC
- 3-(2-{2-[(3-Ethyl-5-methyl-1,3-benzothiazol-2(3H)-ylidene)methyl]but-1-en-1-yl}naphtho[1,2-d][1,3]thiazol-1-ium-1-yl)propane-1-sulfonate
- 영어명
- 2-[2-[(3-Ethyl-5-methyl-2(3H)-benzothiazolylidene)methyl]-1-butenyl]-1-(3-sulfopropyl)naphtho[1,2-d]thiazolium hydroxide, inner salt
- 분자식
- C29H30N2O3S3
- 분자량
- 550.76
이름 및 동의어
ethylmethylbenzothiazolylidenemethylbuten-ylsulfo(ethyl-5-methyl-2(3H)-benzothiazolylidene)methyl-1-butenyl4,5-BENZO-3',9-DIETHYL-5'-METHYL-3-(3-SULFOPROPYL)THIACARBOCYANINE BETAINEETHYLMETHYLBENZOTHIAZOLYLIDENEMETHYLBUTE N-YLSULFOPROPYLNAPHTHOTHIAZOLIUM OH3-(2-(2-(3-Ethyl-5-methyl-3H-benzothiazol-2-ylidenemethyl)but-1-enyl)naphtho[1.2-d]thiazol-1-yl)propane-1-sulfonicacid]1-W-SULFOPROPYL-2-(2-ETHYL-3-(1-ETHYL-6-METHYL-1,3-BENZTHIAZOLIN-2-YLIDEN)-PROP-1-EN-1-YL)-NAPHTHO[5,4A]1,3-THIAZOLIUM-BETAINE2-{2-[(3-ethyl-5-methyl-2(3h)-benzothiazolylidene)methyl]-1-butenyl}-1-(3-sulfopropyl)naphtho[1,2-d]thiazolium hydroxide inner salt2-[2-[(3-Ethyl-5-methyl-2(3H)-benzothiazolylidene)methyl]-1-butenyl]-1-(3-sulfopropyl)naphtho[1,2-d]thiazolium hydroxide, inner salt
데이터베이스 식별자
- CAS
28784-39-6- PubChem CID
- 3608125
- DTXSID
DTXSID10394129
물성
물리화학적 성질
- 녹는점
- 192 °C · 192 °C (dec.)(lit.)
- 산도 계수 (pKa)
- 1.392 · 1.392±0.50(predicted)
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
안전 데이터
- wgk
- 3
- risk_code
- 36/37/38
- hazard_code
- Xi
- safety_code
- 26-36
화학 및 산업
공급사3 곳
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