2-Acetyl-6-methylpyridine

HCID 138872CAS 6940-57-4
부분 구조 검색유사 구조 찾기

기본 정보

표준 SMILES
CC(=O)c1cccc(C)n1
InChIKey
FPQMUQPPAYCAME-UHFFFAOYSA-N
분자식
C8H9NO
평균 분자량
135.16 g/mol
단동위원소 질량
135.06841391

이름 및 식별자

우선 이름
2-Acetyl-6-methylpyridine
IUPAC
1-(6-methyl-2-pyridinyl)ethanone
영어명
1-(6-METHYL-PYRIDIN-2-YL)-ETHANONE
분자식
C8H9NO
분자량
135.16

이름 및 동의어

2-Acetyl-6-methylpyridine6940-57-41-(6-methylpyridin-2-yl)ethanoneKetone, methyl 6-methyl-2-pyridyl6-Acetyl-2-picoline1-(6-Methyl-2-pyridinyl)ethanone6-methyl-2-acetylpyridineAWB2JUD65KNSC-60153ETHANONE, 1-(6-METHYL-2-PYRIDINYL)-DTXSID90219528NSC 60153
이름 더 보기
2-Acyl-6-methylpyridine6-Acetyl-2-methylpyridine2-ACETYL-6-METHYL PYIDINE2-methyl-6-acetylpyridine2-Acetyl-6-Methylpyridine,98%
Methyl 6-methyl-2-pyridyl ketone, 8CI1-(6-Methyl-2-pyridinyl)ethanone, 9CIRefChem:84986DTXCID40142019FPQMUQPPAYCAME-UHFFFAOYSA-N1-(6-Methylpyridin-2-yl)ethan-1-one1-(6-METHYL-PYRIDIN-2-YL)-ETHANONEMFCD06658293

데이터베이스 식별자

CAS
6940-57-4
PubChem CID
138872
DTXSID
DTXSID90219528
ChEBI
CHEBI:179151
UNII
AWB2JUD65K
EC Number
806-088-4
Nikkaji
J2.275.815B

물성

구조 계산 물성

XLogP
1.3
극성 표면적
30 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
2
회전 가능 결합 수
1
무거운 원자 수
10

실험 및 물리화학적 성질

Kovats Retention Index · 3건

1073

1107

1614；1603

물리화학적 성질

끓는 점
209 ℃ · 209℃
밀도
1.036 · 1.036±0.06 g/cm3(Predicted)
인화점
84 ° · 84°(183°F)
굴절률
1.515 · 1.5150
저장 조건
Inert atmosphere,Room Temperature
산도 계수 (pKa)
3.24 · 3.24±0.10(Predicted)

안전 및 규제

GHS 분류

GHS Classification · 5건

Warning

H302 (93.2%): Harmful if swallowed [Warning Acute toxicity, oral]

P264, P270, P301+P317, P330, 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.；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 (93.2%)

안전 데이터

wgk
WGK 3
HS 번호
2933399990
risk_code
36/37/38-22
hazard_code
Xi,Xn
safety_code
26-36
Hazard Classifications
Acute Tox. 4 Oral

화학 및 산업

약리 정보

Cellular LocationsCytoplasm；Extracellular

상·하류 제품 정보

공급사50 곳

常州帝通化工有限公司+86-0519-88298848 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
Shandong chuangyingchemical Co., Ltd.18853181302 · [email protected]
上海伟聂化工科技有限公司13046668259 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]

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