1-METHYL-2-(TRIBUTYLSTANNYL)-1H-피롤
1-methyl-2-(tributylstannyl)-1H-pyrrole
기본 정보
- CAS
118486-97-8- 표준 SMILES
CCC[CH2][Sn]([CH2]CCC)([CH2]CCC)[c]1cccn1C- InChIKey
DINAKCGOEKXDTP-UHFFFAOYSA-N- 분자식
- C17H33NSn
- 평균 분자량
- 370.2 g/mol
- 단동위원소 질량
- 371.16349476
이름 및 식별자
- 우선 이름
- 1-methyl-2-(tributylstannyl)-1H-pyrrole
- IUPAC
- tributyl-(1-methylpyrrol-2-yl)stannane
- 현지명
- 1-METHYL-2-(TRIBUTYLSTANNYL)-1H-피롤
- 영어명
- 1-Methyl-2-(tributylstannyl)-1H-pyrrole
- 분자식
- C17H33NSn
- 분자량
- 370.16
이름 및 동의어
1-methyl-2-(tributylstannyl)-1h-pyrroleRefChem:434022624-775-5118486-97-81-Methyl-2-(tributylstannyl)pyrroleTributyl-(1-methylpyrrol-2-yl)stannane1-METHYL-2-(TRI-N-BUTYLSTANNYL)PYRROLE1-methyl-2-tributylstannylpyrrole1H-Pyrrole,1-methyl-2-(tributylstannyl)-(1-Methylpyrrol-2-yl)tributyltinSCHEMBL203858Tributylstannyl-1-methylpyrrole
이름 더 보기
1-METHYL-2-(TRIBUTYLSTANNYL)-1H-피롤SKL513(1-Methylpyrrol-2-yl)-tributylzinn2-(TRIBUTYLSTANNYL)-1-METHYLPYRROLEN-METHYL-2-(TRIBUTYLSTANNYL)PYRROLE1-N-METHYL-2-(TRIBUTYLSTANNYL)PYRROLETributyl(N-methylpyrrol-2-yl)stannane
2-tributylstannyl-1-methylpyrroleDTXSID00377709DINAKCGOEKXDTP-UHFFFAOYSA-N2-tributylstarinyl-1-methylpyrroleTEA486971-methyl-2-tri-n-butylstannylpyrroleAKOS015843035N-methyl-2-tributylstannyl-1H-pyrrole
데이터베이스 식별자
- CAS
118486-97-8- PubChem CID
- 2769397
- DTXSID
DTXSID00377709- EC Number
- 624-775-5
- Nikkaji
- J1.366.885J
물성
구조 계산 물성
- 극성 표면적
- 4.9 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 0
- 회전 가능 결합 수
- 10
- 무거운 원자 수
- 19
- 형식 전하
- 0
- 복잡도
- 208
물리화학적 성질
- 끓는 점
- 376.3 · 376.3±34.0 °C(Predicted)
- 밀도
- 1.1223 g/mL · 1.1223 g/mL at 25 °C
- 굴절률
- 20 · n20/D 1.5107
- 인화점
- 98 °C · 98 °C
- 저장 조건
- -20 °C · -20°C
- 용해도
- 어렵거나 섞일 수 없음
- 산도 계수 (pKa)
- -2.77 · -2.77±0.70(Predicted)
- InChI
- 1S/C5H6N.3C4H9.Sn/c1-6-4-2-3-5-6;3*1-3-4-2;/h2-4H,1H3;3*1,3-4H2,2H3;
- InChIKey
- DINAKCGOEKXDTP-UHFFFAOYSA-N
- SMILES
- CCCC[Sn](CCCC)(CCCC)c1cccn1C
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS Classification
Danger
H301 (97.8%): Toxic if swallowed [Danger Acute toxicity, oral]
P260, P264, P264+P265, P270, P273, P280, P301+P316, P302+P352, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P391, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 46 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
유해성 정보
Hazard Classes and CategoriesAcute Tox. 3 (97.8%)
안전 데이터
- wgk
- 3
- ridadr
- UN 2788 6.1/PG 2
- HS 번호
- 29321900
- risk_code
- 21-25-36/38-48/23/25-50/53
- hazard_code
- T,Xi,N
- safety_code
- 26-28-36/37-45-60-61
- 위험 등급
- IRRITANT, AIR SENSITIVE, MOISTURE SENSITIVE, KEEP COLD
- Hazard Classifications
- Acute Tox. 3 OralAcute Tox. 4 DermalAquatic Acute 1Aquatic Chronic 1Eye Irrit. 2Repr. 1BSkin Irrit. 2STOT RE 1
- 스토리지 클래스
- 6.1C - Combustible acute toxic Cat.3toxic compounds or compounds which causing chronic effects
화학 및 산업
응용 분야
용도It is employed as intermediate for pharmaceutical.
관련 반응
42건
화합물 노트
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