Ethanamine, 2-[[(tributylstannyl)methyl]thio]-
기본 정보
- CAS
1452829-00-3- 표준 SMILES
CCC[CH2][Sn]([CH2]CCC)([CH2]CCC)[CH2]SCCN- InChIKey
DYBMHPJDHUKXRF-UHFFFAOYSA-N- 분자식
- C15H35NSSn
- 평균 분자량
- 380.2 g/mol
- 단동위원소 질량
- 381.151224
이름 및 식별자
- 우선 이름
- Ethanamine, 2-[[(tributylstannyl)methyl]thio]-
- IUPAC
- 2-(tributylstannylmethylsulfanyl)ethanamine
- 영어명
- SnAP-TM Reagent
- 분자식
- C15H35NSSn
- 분자량
- 380.22
이름 및 동의어
1452829-00-3Ethanamine, 2-(((tributylstannyl)methyl)thio)-Ethanamine, 2-[[(tributylstannyl)methyl]thio]-RefChem:591381809-159-82-(tributylstannylmethylsulfanyl)ethanamineSnAP TM Reagent{[(2-AMINOETHYL)SULFANYL]METHYL}TRIBUTYLSTANNANESnAPTM reagentSnAP-TM ReagentCIC82900AKOS026674359
이름 더 보기
[(2-Aminoethyl)thio]methyltributyltin2-[[(Tributylstannyl)methyl]thio]ethanamine2-(((Tributylstannyl)methyl)thio)ethan-1-amine2-(Tributylstannylmethylsulfanyl)ethanamine - [T9181]
A51272EN300-7408694
데이터베이스 식별자
- CAS
1452829-00-3- PubChem CID
- 71528623
- EC Number
- 809-159-8
- Nikkaji
- J3.207.862A
물성
구조 계산 물성
- 극성 표면적
- 51.3 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 2
- 회전 가능 결합 수
- 13
- 무거운 원자 수
- 18
- 형식 전하
- 0
- 복잡도
- 154
물리화학적 성질
- 끓는 점
- 383.3 · 383.3±52.0 °C(Predicted)
- 밀도
- 1.158 at · 1.158 at 25℃
- 굴절률
- 1.512 · n/D1.512
- 인화점
- 230 ℃ · >230℃
- 저장 조건
- -20 °C · -20°C
- 물리적 상태
- 액체
- 산도 계수 (pKa)
- 9.08 · 9.08±0.10(Predicted)
- InChI
- 1S/3C4H9.C3H8NS.Sn/c3*1-3-4-2;1-5-3-2-4;/h3*1,3-4H2,2H3;1-4H2;
- InChIKey
- DYBMHPJDHUKXRF-UHFFFAOYSA-N
- SMILES
- CCCC[Sn](CCCC)(CSCCN)CCCC
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS Classification
Danger
H301+H311+H331 (97.4%): Toxic if swallowed, in contact with skin or if inhaled [Danger Acute toxicity, oral; acute toxicity, dermal; acute toxicity, inhalation]
P261, P262, P264, P264+P265, P270, P271, P273, P280, P301+P316, P302+P352, P304+P340, P305+P351+P338, P316, P319, P321, P330, P332+P317, P337+P317, P361+P364, P362+P364, P391, 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 CategoriesAcute Tox. 3 (100%)
안전 데이터
- wgk
- WGK 3
- ridadr
- UN 2788 6.1 / PGIII
- 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
용도SnAP Reagents provide a one-step route, in tandem with various aldehyde substrates, to saturatedN-heterocycles. The synthesis ofN-heterocycles through SnAP Reagents requires mild reaction conditions, and aldehydes bearing aryl, heteroaryl,glyoxyl,aliphatic, and halogenated groups are well tolerated. This product was introduced in collaboration with theBode Research Group
일반 설명SnAP (Sn amino protocol) reagents have been developed by the Bode group. SnAP reagents are air and moisture stable. They can be prepared from simple reactions with cheap raw materials. SnAP 2-Spiro-(4-Pip) M, also referred to as SnAP 2-spiro-(4-piperdine) morpholine, is a regioisomeric SnAP reagent. This reagent can be prepared from N-Boc piperidone.
상·하류 제품 정보
상류 원료
관련 반응
0건
현재 필터 조건에 해당하는 반응 기록이 없습니다.
화합물 노트
불러오는 중…