기본 정보
- CAS
667412-78-4- 표준 SMILES
S=c1[nH]nc(C2CC2)n1CC1CCCO1- InChIKey
JCMBZQMCGOBDPK-UHFFFAOYSA-N- 분자식
- C10H15N3OS
- 평균 분자량
- 225.31 g/mol
- 단동위원소 질량
- 225.09358328
이름 및 식별자
- 우선 이름
- 5-cyclopropyl-4-(tetrahydrofuran-2-ylmethyl)-4H-1,2,4-triazole-3-thiol
- IUPAC
- 3-cyclopropyl-4-(oxolan-2-ylmethyl)-1H-1,2,4-triazole-5-thione
- 영어명
- 5-Cyclopropyl-4-(tetrahydrofuran-2-ylmethyl)-4H-1,2,4-triazole-3-thiol
- 분자식
- C10H15N3OS
- 분자량
- 225.31
이름 및 동의어
667412-78-45-cyclopropyl-4-(tetrahydrofuran-2-ylmethyl)-4H-1,2,4-triazole-3-thiolMFCD040545355-Cyclopropyl-4-((tetrahydrofuran-2-yl)methyl)-4H-1,2,4-triazole-3-thiol3-cyclopropyl-4-(oxolan-2-ylmethyl)-1H-1,2,4-triazole-5-thione5-cyclopropyl-4-[(oxolan-2-yl)methyl]-4H-1,2,4-triazole-3-thiolDTXSID903968085-cyclopropyl-4-(oxolan-2-ylmethyl)-1,2,4-triazole-3-thiolALBB-003229BBL017269STK443002AKOS003331350
이름 더 보기
IVK/40214595-cyclopropyl-4-(oxolan-2-ylmethyl)-2H-1,2,4-triazole-3-thione5-cyclopropyl-4-(tetrahydrofurfuryl)-2H-1,2,4-triazole-3-thione5-cyclopropyl-4-(2-tetrahydrofuranylmethyl)-2H-1,2,4-triazole-3-thione5-cyclopropyl-4-(tetrahydrofuran-2-ylmethyl)-2H-1,2,4-triazole-3-thione5-cyclopropyl-4-(tetrahydrofuran-2-ylmethyl)-4H-1,2,4-triazole-3-thiol(SALTDATA: FREE)3H-1,2,4-Triazole-3-thione, 5-cyclopropyl-2,4-dihydro-4-[(tetrahydro-2-furanyl)methyl]-
AKOS017259393VS-06005CS-0322695ST50846315H22647F3074673-cyclopropyl-4-(tetrahydrofuran-2-ylmethyl)-1H-1,2,4-triazole-5-thione5-Cyclopropyl-4-[(oxolan-2-yl)methyl]-2,4-dihydro-3H-1,2,4-triazole-3-thione
물성
구조 계산 물성
- XLogP
- 0.8
- 극성 표면적
- 69 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 3
- 회전 가능 결합 수
- 3
- 무거운 원자 수
- 15
- 형식 전하
- 0
- 복잡도
- 314
물리화학적 성질
- 끓는 점
- 326 · 326.0±34.0 °C(Predicted)
- 밀도
- 1.57 · 1.57±0.1 g/cm3(Predicted)
- 산도 계수 (pKa)
- 8.93 · 8.93±0.20(Predicted)
화학 및 산업
공급사3 곳
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
南京世洲生物科技有限公司025-85563444 15850508050 · [email protected]
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