4-(클로로메틸)-2-페닐-1,3-티아졸

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

HCID 236969CAS 4771-31-7

부분 구조 검색 유사 구조 찾기

기본 정보

표준 SMILES: ClCc1csc(-c2ccccc2)n1
InChIKey: SVEGSFSFMLCNFF-UHFFFAOYSA-N
분자식: C10H8ClNS
평균 분자량: 209.7 g/mol
단동위원소 질량: 209.00659794

이름 및 식별자

우선 이름: 4-(Chloromethyl)-2-phenyl-1,3-thiazole
IUPAC: 4-(chloromethyl)-2-phenyl-1,3-thiazole
현지명: 4-(클로로메틸)-2-페닐-1,3-티아졸
영어명: 4-(Chloromethyl)-2-phenyl-1,3-thiazole
분자식: C10H8ClNS
분자량: 209.7

이름 및 동의어

4-(chloromethyl)-2-phenyl-1,3-thiazoleDTXSID90284978RefChem:515605DTXCID40236129887-450-94771-31-74-(chloromethyl)-2-phenylthiazolethiazole, 4-(chloromethyl)-2-phenyl-MFCD007235032-Phenyl-4-(chloromethyl)thiazole2-phenyl-4-chloromethylthiazole4-chloromethyl-2-phenylthiazole

이름 더 보기

4-(클로로메틸)-2-페닐-1,3-티아졸2-phenyl-4-thiazolylmethyl chloride4-(Chloromethyl)-2-phenyl-1,3-thiazole97%4-(Chloromethyl)-2-phenyl-1,3-thiazole 97%4-(Chloromethyl)-2-phenyl-1,3-thiazole, HCl4-(chloromethyl)-2-phenyl-1,3-thiazole(SALTDATA: FREE)

4-chloromethyl-2-phenyl-thiazoleF0451-1323NSC400384-chloromethyl-2-phenyl-1,3-thiazoleEnamine_002044SCHEMBL118764SVEGSFSFMLCNFF-UHFFFAOYSA-NHMS1399M20

데이터베이스 식별자

CAS: 4771-31-7
PubChem CID: 236969
DTXSID: DTXSID90284978
EC Number: 887-450-9
Nikkaji: J1.387.820J

물성

구조 계산 물성

XLogP: 3
극성 표면적: 41.1 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 2
회전 가능 결합 수: 2
무거운 원자 수: 13
형식 전하: 0
복잡도: 159

물리화학적 성질

녹는점: 49 °C · 49 °C
끓는 점: 155 · 155-156 °C
밀도: 1.27 · 1.270±0.06 g/cm3(Predicted)
저장 조건: 2 · 2-8°C
물리적 상태: 고체
산도 계수 (pKa): 0.22 · 0.22±0.10(Predicted)
색상: 갈색

안전 및 규제

GHS 분류

GHS Classification · 4건

Danger

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P260, P261, P264, P270, P271, P280, P301+P317, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P319, P321, P330, P363, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 2 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.