2-Fluoro-4-methylpyridine-5-boronic acid

HCID 44118243

기본 정보

CAS
1072944-18-3
표준 SMILES
Cc1cc(F)ncc1B(O)O
InChIKey
BAVHOAIWOSIBRD-UHFFFAOYSA-N
분자식
C6H7BFNO2
평균 분자량
154.94 g/mol
단동위원소 질량
155.0553868

이름 및 식별자

우선 이름
2-Fluoro-4-methylpyridine-5-boronic acid
IUPAC
(6-fluoro-4-methyl-3-pyridinyl)boronic acid
영어명
2-Fluoro-4-methylpyridine-5-boronic acid
분자식
C6H7BFNO2
분자량
154.93

이름 및 동의어

2-Fluoro-4-methylpyridine-5-boronic acidRefChem:472391691-618-51072944-18-32-Fluoro-4-methyl-5-pyridineboronic acid(6-fluoro-4-methylpyridin-3-yl)boronic acidMFCD087414066-Fluoro-4-methyl-3-pyridineboronic Acid(6-fluoro-4-methyl-3-pyridinyl)boronic acid2-Fluoro-4-methylpyridine-5-boronic2-Fluoro-4-Methylpyridine-5-BoronicAcid2-Fluoro-4-methyl-5-pyridineboronicacid
이름 더 보기
CAS:1072944-18-32-F -4-Me-5-pyridine boronic acid3-Borono-6-fluoro-4-methylpyridine2-Fluoro-4-Methylpyridine-5-BoronicAci6-Fluoro-4-methylpyridine-3-boronic acid
EN300-316411F15471(6-fluoro-4-methyl-3-pyridyl)boronic acidAMY7909BCP106332-Fluoro-4-methylpyridSCHEMBL2725352SCHEMBL30087245

데이터베이스 식별자

CAS
1072944-18-3
PubChem CID
44118243
DTXSID
DTXSID70656790
EC Number
691-618-5

물성

구조 계산 물성

극성 표면적
53.4 Ų
수소 결합 공여자 수
2
수소 결합 수용자 수
4
회전 가능 결합 수
1
무거운 원자 수
11

물리화학적 성질

끓는 점
331.6 · 331.6±52.0 °C(Predicted)
밀도
1.28 · 1.28±0.1 g/cm3(Predicted)
저장 조건
2 · under inert gas (nitrogen or Argon) at 2-8°C
산도 계수 (pKa)
7.05 · 7.05±0.58(Predicted)

안전 및 규제

GHS 분류

GHS Classification · 5건

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral];H312 (100%): Harmful in contact with skin [Warning Acute toxicity, dermal];H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation];H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation];H332 (100%): Harmful if inhaled [Warning Acute toxicity, inhalation];H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.;Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

유해성 정보

Hazard Classes and CategoriesAcute Tox. 4 (100%);Acute Tox. 4 (100%);Skin Irrit. 2 (100%);Eye Irrit. 2 (100%);Acute Tox. 4 (100%);STOT SE 3 (100%)

안전 데이터

HS 번호
2933399990

화학 및 산업

공급사100 곳

上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
毕佳索(上海毕得医药科技股份有限公司)400-6005915 · [email protected]
陕西缔都化学有限公司029-029-81123119 17391733320 · [email protected]
T&W GROUP021-61551611 13296011611 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]

관련 반응

3건

화합물 노트

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