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기본 정보
- CAS
154003-23-3- 표준 SMILES
Cc1ccc(S(=O)(=O)[O-])c(C)c1C1COC(Cn2cncn2)(c2ccc(Cl)cc2Cl)O1- InChIKey
WAYJYHNFFMNZJA-UHFFFAOYSA-M- 분자식
- C20H18Cl2N3O5S-
- 평균 분자량
- 483.353 g/mol
- 단동위원소 질량
- 482.03497062
이름 및 식별자
- 우선 이름
- 3-{2-(2,4-Dichlorophenyl)-2-[(1H-1,2,4-triazol-1-yl)methyl]-1,3-dioxolan-4-yl}-2,4-dimethylbenzene-1-sulfonate
- IUPAC
- 3-{2-(2,4-Dichlorophenyl)-2-[(1H-1,2,4-triazol-1-yl)methyl]-1,3-dioxolan-4-yl}-2,4-dimethylbenzene-1-sulfonate
- 영어명
- Cis -Tosylate
- 분자식
- C20H19Cl2N3O5S
- 분자량
- 484.35
이름 및 동의어
ItracozoleImpurity6Cis-[2-(2,4-Dichlorophenyl)-2-(1H-1,2,4-triazol-1-ylmethyl)-...3-[2-(2,4-dichlorophenyl)-2-(1,2,4-triazol-1-ylmethyl)-1,3-dioxolan-4-yl]-2,4-dimethylbenzenesulfonate3- [2-(2,4-dichlorophenyl)-2-(1,2,4-triazol-1-ylmethyl)-1,3-dioxolane-4-yl] -2,4-dimethylbenzenesulfonateCis-[2-(2,4-Dichlorophenyl)-2-(1H-1,2,4-Triazol-1-ylmethyl)-1,3-Dioxolan-4-ylMethyl-4- MethlbenzenesulphonateCis-[2-(2,4-Dichlorophenyl)-2-(1h-1,2,4-Triazol-1-Ylmethyl)-1,3-Dioxolan-4-Yl]Methyl-4-Methylbenzenesulphonate(2R,4R)-[2-(2,4-Dichlorophenyl)-2-(1H-1,2,4-triazol-1-ylmethyl)-1,3-dioxolan-4-yl]methyl-4-methylbenzenesulphonate((2S,4S)-2-((1H-1,2,4-triazo1-1-yl)methyl)-2-(2,4-dichlorophenyl)1,3-dioxolan-4-yl)methyl 4-methylbenzenesulfonateCis-[2-(2,4-Dichlorophenyl)-2-(1H-1,2,4-Triazol-1-Chemicalbookylmethyl)-1,3-Dioxolan-4-ylMethyl-4-Methlbenzenesulphonate1,3-Dioxolane-4-methanol, 2-(2,4-dichlorophenyl)-2-(1H-1,2,4-triazol-1-ylmethyl)-, 4-(4-methylbenzenesulfonate), (2R,4R)-
데이터베이스 식별자
- CAS
154003-23-3
물성
물리화학적 성질
- 녹는점
- 184 · 184-186 °C(Solv: acetonitrile (75-05-8))
- 끓는 점
- 657.7 · 657.7±65.0 °C(Predicted)
- 밀도
- 1.49 · 1.49±0.1 g/cm3(Predicted)
- 산도 계수 (pKa)
- 2.94 · 2.94±0.12(Predicted)
- InChIKey
- PDLOCUOFXZQVGN-UHFFFAOYSA-N
- SMILES
- C1(OCC(CO)O1)(CN1N=CN=C1)C1C(Cl)=CC(Cl)=CC=1.S(O)(=O)(=O)C1C=CC(C)=CC=1
화학 및 산업
상·하류 제품 정보
상류 원료
공급사26 곳
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