6,6'-Bi-2-picoline
기본 정보
- CAS
4411-80-7- 표준 SMILES
Cc1cccc(-c2cccc(C)n2)n1- InChIKey
OHJPGUSXUGHOGE-UHFFFAOYSA-N- 분자식
- C12H12N2
- 평균 분자량
- 184.24 g/mol
- 단동위원소 질량
- 184.10004838
이름 및 식별자
- 우선 이름
- 6,6'-Bi-2-picoline
- IUPAC
- 2-methyl-6-(6-methyl-2-pyridinyl)pyridine
- 영어명
- 6,6'-Dimethyl-2,2'-dipyridyl
- 분자식
- C12H12N2
- 분자량
- 184.24
이름 및 동의어
6,6'-Dimethyl-2,2'-bipyridine4411-80-76,6'-Dimethyl-2,2'-bipyridyl6,6'-Bi-2-picoline6,6'-Dimethyl-2,2'-dipyridyl2,2'-BIPYRIDINE, 6,6'-DIMETHYL-NSC 4705EINECS 224-566-5AF3HZ0ZAN4BRN 0128972NSC-4705DTXSID30196041
이름 더 보기
Bipicoline6,6’-dimethyl-2’-bipyridineAKOS BBS-000001876,6''-BI-2-PICOLINE 98+%6,6-DIMETHYL-2,2-DIPYRIDYL6'-DiMethyl-2,2'-dipyridyl
RefChem:538445DTXCID40118532224-566-5InChI=1/C12H12N2/c1-9-5-3-7-11(13-9)12-8-4-6-10(2)14-12/h3-8H,1-2H2-methyl-6-(6-methylpyridin-2-yl)pyridineMFCD000597766,6'-Di-2-picolylCHEMBL2205806
데이터베이스 식별자
- CAS
4411-80-7- PubChem CID
- 20445
- DTXSID
DTXSID30196041- ChEMBL
CHEMBL2205806- UNII
- AF3HZ0ZAN4
- EC Number
- 224-566-5
- Nikkaji
- J23.946A
물성
구조 계산 물성
- XLogP
- 2.3
- 극성 표면적
- 25.8 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 2
- 회전 가능 결합 수
- 1
- 무거운 원자 수
- 14
- 형식 전하
- 0
- 복잡도
- 161
물리화학적 성질
- 녹는점
- 93 · 93-95 °C(lit.)
- 끓는 점
- 286 °C · 286 °C
- 밀도
- 1.06 · 1.060±0.06 g/cm3(Predicted)
- 저장 조건
- Sealed in dry,Room Temperature
- 용해도
- almost transparency in Methanol
- 물리적 상태
- powder to crystaline
- 산도 계수 (pKa)
- 5.2 · 5.20±0.22(Predicted)
- 색상
- 흰색에서 밝은 노란색
- InChI
- InChI=1S/C12H12N2/c1-9-5-3-7-11(13-9)12-8-4-6-10(2)14-12/h3-8H,1-2H3
- InChIKey
- OHJPGUSXUGHOGE-UHFFFAOYSA-N
- SMILES
- C1(C2=NC(C)=CC=C2)=NC(C)=CC=C1
화학적 성질
White to light brown crystal or powder
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 44 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
유해성 정보
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
안전 데이터
- wgk
- 3
- rtecs
- DW1767000
- HS 번호
- 29333990
- risk_code
- 36/37/38
- hazard_code
- Xi
- safety_code
- 26-36
- Hazard Classifications
- Eye Irrit. 2Skin Irrit. 2STOT SE 3
- 스토리지 클래스
- 11 - Combustible Solids
화학 및 산업
응용 분야
용도6,6′-dimethyl-2,2′-bipyridyl (6,6′-Dimethyl-2,2′-bipyridine)may be used in the synthesis of novel oligobipyridine ligands.
일반 설명6,6′-dimethyl-2,2′-bipyridyl (dmbp) also known as 6,6′-dimethyl-2,2′-bipyridine, is commonly used as a ligand to form complexes with ions such as Pd(II), Pt(II), Cu(II), Co(II) and Zn(II). The crystalline structure of dmbp has been investigated. Its synthesis from 6-bromopicoline has been reported.
상·하류 제품 정보
상류 원료
관련 반응
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