기본 정보
- CAS
701911-46-8- 표준 SMILES
CCn1nc(C)c(C=O)c1C- InChIKey
NDKOKWXOWTVYJR-UHFFFAOYSA-N- 분자식
- C8H12N2O
- 평균 분자량
- 152.19 g/mol
- 단동위원소 질량
- 152.09496301
이름 및 식별자
- 우선 이름
- 1-Ethyl-3,5-dimethyl-1H-pyrazole-4-carbaldehyde
- IUPAC
- 1-ethyl-3,5-dimethylpyrazole-4-carbaldehyde
- 영어명
- 1H-Pyrazole-4-carboxaldehyde, 1-ethyl-3,5-dimethyl- (9CI)
- 분자식
- C8H12N2O
- 분자량
- 152.19
이름 및 동의어
1-Ethyl-3,5-dimethyl-1H-pyrazole-4-carbaldehyde701911-46-8DTXSID40390119RefChem:230282DTXCID70340980812-002-61-ethyl-3,5-dimethylpyrazole-4-carbaldehydeMFCD022537521H-Pyrazole-4-carboxaldehyde, 1-ethyl-3,5-diMethyl- (9CI)SCHEMBL3322655STK315883AS-67397
이름 더 보기
1-ethyl-3,5-dimethyl-4-pyrazolecarboxaldehyde1-Ethyl-3,5-diMethyl-1H-pyrazole-4-carboxaldehyde1H-Pyrazole-4-carboxaldehyde, 1-ethyl-3,5-dimethyl-1-Ethyl-3,5-dimethyl-1H-pyrazole-4-carbaldehyde - [E3276]1-Ethyl-3,5-Dimethyl-1H-pyrazole-4-carbaldehyde AldrichCPR1-ethyl-3,5-dimethyl-1H-pyrazole-4-carbaldehyde(SALTDATA: FREE)
BP-10568SY017762EN300-657383,5-dimethyl-1-ethyl-1h-pyrazole-4-carboxaldehydeAMY33043BB 0219273FT-0687733ALBB-000344
데이터베이스 식별자
- CAS
701911-46-8- PubChem CID
- 3157461
- DTXSID
DTXSID40390119- EC Number
- 812-002-6
- Nikkaji
- J2.040.371C
물성
구조 계산 물성
- XLogP
- 0.8
- 극성 표면적
- 34.9 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 2
- 회전 가능 결합 수
- 2
- 무거운 원자 수
- 11
- 형식 전하
- 0
- 복잡도
- 149
물리화학적 성질
- 끓는 점
- 142 ℃ · 142℃ (30 Torr)
- 밀도
- 1.06 · 1.06±0.1 g/cm3 (20 ºC 760 Torr)
- 굴절률
- 1.5176 · 1.5176 (589.3 nm 20℃)
- 인화점
- 108 · 108.0±25.9℃
- 저장 조건
- 2 · Storage temp. 2-8°C
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS Classification
Warning
H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；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, 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 (50%)；Skin Irrit. 2 (100%)；Eye Irrit. 2A (100%)；STOT SE 3 (100%)
안전 데이터
- HS 번호
- 2933199090
- risk_code
- 22
- hazard_code
- Xn
화학 및 산업
공급사52 곳
广州诚创生物科技有限公司18027266590 · [email protected]
陕西缔都医药有限责任公司029-81124775 17791530730 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
Hebei Chuanghai Biotechnology Co., Ltd+86-17732866630 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
郑州汇聚化工有限公司13393710386 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
北京炎礼生物科技有限公司18600731423 · [email protected]
长沙麓兴生物科技有限公司0731-88827538 15574813303 · [email protected]
北京亿思研科技开发中心010-56645598 13366904824 · [email protected]
Young Lively PharminBlock Co.,Ltd18600731423 · [email protected]
安徽合诺生物科技有限公司18455579438
北京零式京安科技有限责任公司10-61256048 13810278579 · [email protected]
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