에틸2-페닐-3-(트리플루오로메틸)피라졸-4-카르복실레이트

Ethyl 1-phenyl-5-(trifluoromethyl)-1h-pyrazole-4-carboxylate

HCID 2780269CAS 112055-34-2
부분 구조 검색유사 구조 찾기

기본 정보

표준 SMILES
CCOC(=O)c1cnn(-c2ccccc2)c1C(F)(F)F
InChIKey
ZJGRCTISRZQYRY-UHFFFAOYSA-N
분자식
C13H11F3N2O2
평균 분자량
284.23 g/mol
단동위원소 질량
284.07726225

이름 및 식별자

우선 이름
Ethyl 1-phenyl-5-(trifluoromethyl)-1h-pyrazole-4-carboxylate
IUPAC
ethyl 1-phenyl-5-(trifluoromethyl)pyrazole-4-carboxylate
현지명
에틸2-페닐-3-(트리플루오로메틸)피라졸-4-카르복실레이트
영어명
Ethyl 2-phenyl-3-(trifluoromethyl)pyrazole-4-carboxylate
분자식
C13H11F3N2O2
분자량
284.23

이름 및 동의어

112055-34-2ethyl 1-phenyl-5-(trifluoromethyl)-1h-pyrazole-4-carboxylateEthyl 2-phenyl-3-(trifluoromethyl)pyrazole-4-carboxylate1-Phenyl-5-trifluoromethyl-1H-pyrazole-4-carboxylic acid ethyl esterethyl 1-phenyl-5-(trifluoromethyl)pyrazole-4-carboxylateMFCD00068138ethyl 5-(trifluoromethyl)-1-phenyl-1h-pyrazole-4-carboxylateC13H11F3N2O2SCHEMBL1814204DTXSID20920655AKOS009165360PS-7201
이름 더 보기
에틸2-페닐-3-(트리플루오로메틸)피라졸-4-카르복실레이트BUTTPARK 46\18-19Ethyl 2-phenyl-3-(trifluoromethyl)pyrazole-4-Ethyl2-phenyl-3-(trifluoromethyl)-1H-pyrazole-4-carBoxylate1H-Pyrazole-4-carboxylic acid, 1-phenyl-5-(trifluoroMethyl)-, ethyl ester
AC-26700DB-074794CS-0308722E87390EN300-128999F008316Ethyl 1-phenyl-5-trifluoromethyl-1H-pyrazole-4-carboxylateEthyl1-phenyl-3-(trifluoromethyl)-1H-pyrazole-4-carboxylate

데이터베이스 식별자

CAS
112055-34-2
PubChem CID
2780269
DTXSID
DTXSID20920655
EC Number
802-475-7

물성

구조 계산 물성

XLogP
3
극성 표면적
44.1 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
6
회전 가능 결합 수
4
무거운 원자 수
20

물리화학적 성질

끓는 점
122 °C · 122 °C
밀도
1.3 · 1.30±0.1 g/cm3(Predicted)
저장 조건
2 · 2-8°C
산도 계수 (pKa)
-5.86 · -5.86±0.10(Predicted)

안전 및 규제

GHS 분류

GHS Classification · 4건

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 38 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

안전 데이터

wgk
3
HS 번호
2933199090
risk_code
36/37/38
hazard_code
Xi
safety_code
26-36
위험 참고 사항
Irritant

화학 및 산업

상·하류 제품 정보

공급사29 곳

Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
Aladdin Scientific[email protected]
Hangzhou Sage Chemical Co., Ltd.+86057186818502 13588463833 · [email protected]
武汉凯威斯科技有限公司86-027-67849912 · [email protected]
上海景颜化工科技有限公司13817811078 · [email protected]

관련 반응

4건
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