(+-)-alpha-(2,4-Dichlorophenyl)-1H-imidazole-1-ethanol

HCID 32238CAS 24155-42-8

기본 정보

표준 SMILES
OC(Cn1ccnc1)c1ccc(Cl)cc1Cl
InChIKey
UKVLTPAGJIYSGN-UHFFFAOYSA-N
분자식
C11H10Cl2N2O
평균 분자량
257.11 g/mol
단동위원소 질량
256.0170183

이름 및 식별자

우선 이름
(+-)-alpha-(2,4-Dichlorophenyl)-1H-imidazole-1-ethanol
IUPAC
1-(2,4-dichlorophenyl)-2-imidazol-1-ylethanol
영어명
alpha-(2,4-Dichlorophenyl)-1H-imidazole-1-ethanol
분자식
C11H10Cl2N2O
분자량
257.12

이름 및 동의어

24155-42-8CP4AM80T681H-Imidazole-1-ethanol, alpha-(2,4-dichlorophenyl)-1-(2-(2,4-Dichlorophenyl)-2-hydroxyethyl)-1H-imidazole1-[2-(2,4-Dichlorophenyl)-2-hydroxyethyl]-1H-imidazoleRefChem:390687(+-)-alpha-(2,4-Dichlorophenyl)-1H-imidazole-1-ethanolalpha-(2,4-Dichlorophenyl)-1H-imidazole-1-ethanol1-(2,4-Dichlorophenyl)-2-(1H-imidazol-1-yl)ethanol1-(2,4-Dichlorophenyl)-2-(1-imidazolyl)ethanol1-(2,4-dichlorophenyl)-2-imidazol-1-ylethanol1-(2,4-dichlorophenyl)-2-(1H-imidazol-1-yl)ethan-1-ol
이름 더 보기
Imidazole alcoholIMIDAZOLE ETHANOLt824r14821MIC IIISQ-132831-[2-(2,4-DichL)-2-hydroxyethyL
MFCD000447081-(2,4-DICHLORO-PHENYL)-2-IMIDAZOL-1-YL-ETHANOLCHEMBL13271-[2-(2,4-Dichlorophenyl)-2-hydroxyethyl]imidazole(1RS)-1-(2,4-Dichlorophenyl)-2-(1H-imidazol-1-yl)ethanol1-(2,4-dichlorophenyl)-2-imidazolylethan-1-olEINECS 246-042-5BRN 0617090

데이터베이스 식별자

CAS
24155-42-8
PubChem CID
32238
DTXSID
DTXSID3074737
ChEMBL
CHEMBL1327
UNII
CP4AM80T68
EC Number
246-042-5
Nikkaji
J86.829I

물성

구조 계산 물성

XLogP
2.6
극성 표면적
38.1 Ų
수소 결합 공여자 수
1
수소 결합 수용자 수
2
회전 가능 결합 수
3
무거운 원자 수
16

물리화학적 성질

녹는점
134 · 134-138 °C
끓는 점
468.5 · 468.5±45.0 °C(Predicted)
밀도
1.4133 · 1.4133 (rough estimate)
증기압
0 Pa · 0Pa at 20℃
굴절률
1.55 · 1.5500 (estimate)
저장 조건
Sealed in dry,Room Temperature

화학적 성질

cream-coloured to beige powder

안전 및 규제

GHS 분류

GHS Classification · 5건

Warning

H302 (81%): Harmful if swallowed [Warning Acute toxicity, oral];H312 (15.5%): Harmful in contact with skin [Warning Acute toxicity, dermal];H315 (17.2%): Causes skin irritation [Warning Skin corrosion/irritation];H319 (39.7%): Causes serious eye irritation [Warning Serious eye damage/eye irritation];H332 (15.5%): Harmful if inhaled [Warning Acute toxicity, inhalation];H335 (15.5%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation];H371 (15.5%): May cause damage to organs [Warning Specific target organ toxicity, single exposure];H400 (17.2%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard];H411 (19%): Toxic to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]

P260, P261, P264, P264+P265, P270, P271, P273, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P308+P316, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P391, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 58 reports by companies from 8 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

Regulatory InformationStatus: Active Update: 21-10-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/18973;Status: Active Update: 10-02-2020 https://echa.europa.eu/registration-dossier/-/registered-dossier/12252
Hazard Classes and CategoriesAcute Tox. 4 (81%);Acute Tox. 4 (15.5%);Skin Irrit. 2 (17.2%);Eye Irrit. 2 (39.7%);Acute Tox. 4 (15.5%);STOT SE 3 (15.5%);STOT SE 2 (15.5%);Aquatic Acute 1 (17.2%);Aquatic Chronic 2 (19%)

규제 정보

Regulatory InformationStatus: Active Update: 21-10-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/18973;Status: Active Update: 10-02-2020 https://echa.europa.eu/registration-dossier/-/registered-dossier/12252

안전 데이터

wgk
3
rtecs
NI5485000
HS 번호
2933290000
risk_code
22-36/37/38
hazard_code
Xn,Xi
safety_code
38-28B-36-26

화학 및 산업

용도 및 제조

Use ClassificationEnvironmental transformation -> Pesticide transformation products (metabolite, successor)

응용 분야

용도Intermediate in the preparation of Miconazole. An impurity in the synthesis of Fenticonazole. An impurity in the synthesis of Ketoconazole.

공급사50 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]
山东瑞博恩新材料科技有限公司15064961989 · [email protected]
合肥翰刚医药科技有限公司+8618062405514 · [email protected]
广州隽沐生物科技股份有限公司020-36607679; 13502246435 · [email protected]

관련 반응

29건

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