기본 정보
- CAS
913835-86-6- 표준 SMILES
Cc1cnc(Cl)c(B(O)O)c1- InChIKey
ZMHWEBDZKPQNHG-UHFFFAOYSA-N- 분자식
- C6H7BClNO2
- 평균 분자량
- 171.39 g/mol
- 단동위원소 질량
- 171.02583654
이름 및 식별자
- 우선 이름
- 2-Chloro-5-methylpyridine-3-boronic acid
- IUPAC
- (2-chloro-5-methyl-3-pyridinyl)boronic acid
- 현지명
- 2-클로로-5-메틸피리딘-3-보론산98
- 영어명
- 2-CHLORO-5-METHYLPYRIDINE-3-BORONIC ACID 98
- 분자식
- C6H7BClNO2
- 분자량
- 171.39
이름 및 동의어
913835-86-62-CHLORO-5-METHYLPYRIDINE-3-BORONIC ACIDDTXSID40376751RefChem:469412DTXCID50327779692-572-9(2-chloro-5-methylpyridin-3-yl)boronic acidMFCD041125632-CHLORO-5-METHYLPYRIDINE-3-BORONIC ACID 982-Chloro-5-picoline-3-boronic acidBoronicacid, B-(2-chloro-5-methyl-3-pyridinyl)-2-chloro-5-methylpyridin-3-ylboronic acid
이름 더 보기
2-클로로-5-메틸피리딘-3-보론산982-Chloro-5-methylpyridine-3-boronicaci2-chlorine-5-methylpyridine-3-boronic acid2-Chloro-5-methylpyridine-3-boronic acid 98%Boronic acid, B-(2-chloro-5-methyl-3-pyridinyl)-(2-chloro-5-methyl-3-pyridinyl)boronic acid(SALTDATA: FREE)2-Chloro-5-methylpyridine-3-boronic acid (contains varying amounts of Anhydride)
(2-CHLORO-5-METHYL-3-PYRIDYL)BORONIC ACIDSCHEMBL114106SCHEMBL29911650ZMHWEBDZKPQNHG-UHFFFAOYSA-N2-Chloro-5-picoline-3-boronicacidAKOS006222938AB17628CS-W003928
데이터베이스 식별자
- CAS
913835-86-6- PubChem CID
- 2763126
- DTXSID
DTXSID40376751- EC Number
- 692-572-9
물성
구조 계산 물성
- 극성 표면적
- 53.4 Ų
- 수소 결합 공여자 수
- 2
- 수소 결합 수용자 수
- 3
- 회전 가능 결합 수
- 1
- 무거운 원자 수
- 11
- 형식 전하
- 0
- 복잡도
- 136
물리화학적 성질
- 녹는점
- 115 · 115-118
- 끓는 점
- 373.1 · 373.1±52.0 °C(Predicted)
- 밀도
- 1.34 · 1.34
- 저장 조건
- 2 · Inert atmosphere,2-8°C
- 산도 계수 (pKa)
- 6.68 · 6.68±0.58(Predicted)
- 물리적 상태
- 고체
- 색상
- 하얀색
안전 및 규제
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 5 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 CategoriesSkin Irrit. 2 (100%)
안전 데이터
- HS 번호
- 2933399990
- hazard_code
- Xi
- 위험 참고 사항
- Irritant/Keep Cold
화학 및 산업
공급사84 곳
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