4-(클로로메틸)-2-(4-클로로페닐)-1,3-티아졸

4-(Chloromethyl)-2-(4-chlorophenyl)-1,3-thiazole

HCID 610297

노트 반응

부분 구조 검색 유사 구조 찾기

기본 정보

CAS: 17969-22-1
표준 SMILES: ClCc1csc(-c2ccc(Cl)cc2)n1
InChIKey: UEJQTBKTWJQBRN-UHFFFAOYSA-N
분자식: C10H7Cl2NS
평균 분자량: 244.14 g/mol
단동위원소 질량: 242.9676258

이름 및 식별자

우선 이름: 4-(Chloromethyl)-2-(4-chlorophenyl)-1,3-thiazole
IUPAC: 4-(chloromethyl)-2-(4-chlorophenyl)-1,3-thiazole
현지명: 4-(클로로메틸)-2-(4-클로로페닐)-1,3-티아졸
영어명: 4-(CHLOROMETHYL)-2-(4-CHLOROPHENYL)-1,3-THIAZOLE
분자식: C10H7Cl2NS
분자량: 244.14

이름 및 동의어

4-(Chloromethyl)-2-(4-chlorophenyl)-1,3-thiazole17969-22-1DTXSID70346189RefChem:288693DTXCID10297262814-496-94-(Chloromethyl)-2-(4-chlorophenyl)thiazoleThiazole, 4-(chloromethyl)-2-(4-chlorophenyl)-MFCD00047057Thiazole, 4-(chloromethyl)-2-(p-chlorophenyl)-4-CHLOROMETHYL-2-(4-CHLORO-PHENYL)-THIAZOLEThiazole,4-(chloromethyl)-2-(4-chlorophenyl)-

이름 더 보기

4-(클로로메틸)-2-(4-클로로페닐)-1,3-티아졸4-(Chloromethyl)-2-(4-chlorophenyl)-12-(chloromethyl)-4-(4-chlorophenyl)thiazole4-(Chloromethyl)-2-(4-chlorophenyl)-1,3-thiazole, HCl

MLS000389685SCHEMBL203617CHEMBL510132F2145-0261HMS2543N17ALBB-002334CS-M2028STK470393

데이터베이스 식별자

CAS: 17969-22-1
PubChem CID: 610297
DTXSID: DTXSID70346189
ChEMBL: CHEMBL510132
EC Number: 814-496-9
Nikkaji: J143.006H

물성

구조 계산 물성

XLogP: 3.7
극성 표면적: 41.1 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 2
회전 가능 결합 수: 2
무거운 원자 수: 14
형식 전하: 0
복잡도: 183

물리화학적 성질

녹는점: 78 °C · 78 °C
끓는 점: 373.989 · 373.989±52.00 °C(Press: 760.00 Torr)(predicted)
밀도: 1.379 · 1.379±0.06 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
저장 조건: -20 °C, · -20°C, stored under nitrogen
산도 계수 (pKa): -0.289 · -0.289±0.10(predicted)

안전 및 규제

GHS 분류

GHS Classification · 5건

Danger

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；H312 (50%): Harmful in contact with skin [Warning Acute toxicity, dermal]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H318 (50%): Causes serious eye damage [Danger Serious eye damage/eye irritation]；H319 (50%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H332 (50%): Harmful if inhaled [Warning Acute toxicity, inhalation]；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, P305+P354+P338, P317, 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 (100%)；Acute Tox. 4 (50%)；Skin Irrit. 2 (100%)；Eye Dam. 1 (50%)；Eye Irrit. 2 (50%)；Acute Tox. 4 (50%)；STOT SE 3 (100%)