N-[4-시아노-3-(트리플루오로메틸)페닐]-2-메타크릴아미드

N-[4-Cyano-3-(trifluoromethyl)phenyl]-2-methylprop-2-enamide

HCID 11149469
노트반응
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기본 정보

CAS
90357-53-2
표준 SMILES
C=C(C)C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1
InChIKey
HHWDZLSGDDXUSM-UHFFFAOYSA-N
분자식
C12H9F3N2O
평균 분자량
254.21 g/mol
단동위원소 질량
254.06669757

개요

See other relationships...

이름 및 식별자

우선 이름
N-[4-Cyano-3-(trifluoromethyl)phenyl]-2-methylprop-2-enamide
IUPAC
N-[4-cyano-3-(trifluoromethyl)phenyl]-2-methylprop-2-enamide
현지명
N-[4-시아노-3-(트리플루오로메틸)페닐]-2-메타크릴아미드
영어명
N-[4-Cyano-3-(trifluoromethyl)phenyl]-2-methacrylamide
분자식
C12H9F3N2O
분자량
254.21

이름 및 동의어

N-[4-Cyano-3-(trifluoromethyl)phenyl]-2-methylacrylamideN-[4-cyano-3-(trifluoromethyl)phenyl]-2-methylprop-2-enamideEC 427-880-2N-(4-Cyano-3-trifluoromethylphenyl)methacrylamideDTXSID20456989N-[4-Cyano-3-trifluoromethylphenyl]methacrylamideN-(4-Cyano-3-(trifluoromethyl)phenyl)-2-methylacrylamideN-(4-cyano-3-(trifluoromethyl)phenyl)-2-methylprop-2-enamideRefChem:828824DTXCID50407808427-880-290357-53-2
이름 더 보기
N-[4-시아노-3-(트리플루오로메틸)페닐]-2-메타크릴아미드Bicalutamide Impurity 194'-Cyano-3'-trifluoromethylmethacryl anilideN - (4-Cyano-3-trifluoromethylphenyl) methylacrylamide2-Methyl-N-[(4-cyano-3-trifluoromethyl)phenyl]-propenamideN-{[4-cyano-3-(trifluoroMethyl)phenyl]Methyl}prop-2-enaMide
N-(4-cyano-3-(trifluoromethyl)phenyl)methacrylamideN-[4-Cyano-3-(trifluoromethyl)phenyl]-2-methacrylamideN-methacryloyl-4-cyano-3-trifluoromethylanilineN-[4-cyano-3-(trifluoromethyl)phenyl]methacrylamide2-Propenamide, N-[4-cyano-3-(trifluoromethyl)phenyl]-2-methyl-MFCD03411609Bicalutamide Impurity 212-Propenamide, N-[4-cyano-3-(trifluoromethyl)phenyl]-2-methyl-; N-[4-Cyano-3-(trifluoromethyl)phenyl]-2-methyl-2-propenamide; N-[4-Cyano-3-(trifluoromethyl)phenyl]-2-methylacrylamide; N-[4-Cyano-3-(trifluoromethyl)phenyl]-2-methylprop-2-enamide

데이터베이스 식별자

CAS
90357-53-2
PubChem CID
11149469
DTXSID
DTXSID20456989
UNII
AG285KB3SV
EC Number
427-880-2
Nikkaji
J1.989.778H

물성

구조 계산 물성

XLogP
2.7
극성 표면적
52.9 Ų
수소 결합 공여자 수
1
수소 결합 수용자 수
5
회전 가능 결합 수
2
무거운 원자 수
18

실험 및 물리화학적 성질

PFASPFAS -> PFAS identified in REACH Regulation EC No. 1272/2008

물리화학적 성질

녹는점
137 · 137-139 °C
끓는 점
395.5 · 395.5±42.0 °C(Predicted)
밀도
1.28 · 1.28
저장 조건
2 · 2-8°C
용해도
아세토니트릴(약간 용해됨), 클로로포름(약간 용해됨)
산도 계수 (pKa)
12.19 · 12.19±0.70(Predicted)

안전 및 규제

GHS 분류

GHS Classification · 6건

Warning

H373 **: May causes damage to organs through prolonged or repeated exposure [Warning Specific target organ toxicity, repeated exposure]

P260, P273, P319, P391, and P501 (click each P-code to see the statement)

Warning

H302+H312+H332 (25%): Harmful if swallowed, in contact with skin or if inhaled [Warning Acute toxicity, oral; acute toxicity, dermal; acute toxicity, inhalation]

P260, P261, P264, P264+P265, P270, P271, P273, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P391, P403+P233, P405, and P501 (click each P-code to see the statement)

유해성 정보

Regulatory InformationStatus: Active Update: 02-05-2018 https://echa.europa.eu/registration-dossier/-/registered-dossier/24610
Hazard Classes and Categories · 3건

Acute Tox. 4 (50%)

Specific target organ toxicity (repeated exposure) - category 2

STOT RE 2 *

안전 데이터

ridadr
3077
HS 번호
2926.90.5050
포장분류
III
위험 등급
9

화학 및 산업

응용 분야

용도N-[4-Cyano-3-(trifluoromethyl)phenyl]-2-methylacrylamide was used to prepare and observe selective androgen receptor modulator activity.

상·하류 제품 정보

공급사100 곳

梯希爱(上海)化成工业发展有限公司021-67121386 · [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]
陕西缔都新材料有限公司81124267 17392282731 · [email protected]
艾吉析科技（上海）有限公司17717235263 · [email protected]

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