3,4-디클로로카테콜

3,4-Dichlorocatechol

HCID 19877CAS 25167-85-5

부분 구조 검색 유사 구조 찾기

기본 정보

표준 SMILES: Oc1ccc(Cl)c(Cl)c1O
InChIKey: HFSXRRTUWAPWSJ-UHFFFAOYSA-N
분자식: C6H4Cl2O2
평균 분자량: 179 g/mol
단동위원소 질량: 177.9588348

이름 및 식별자

우선 이름: 3,4-Dichlorocatechol
IUPAC: 3,4-dichlorobenzene-1,2-diol
현지명: 3,4-디클로로카테콜
영어명: 3,4-dichlorocatechol
분자식: C6H4Cl2O2
분자량: 179

이름 및 동의어

3,4-DICHLOROCATECHOL3978-67-43,4-Dichloro-1,2-benzenediolDCBZDTXSID3073973CHEBI:90882RefChem:485979DTXCID20396793,4-dichlorobenzene-1,2-diolMFCD247134701,2-Benzenediol, 3,4-dichloro-1,2-Benzenediol, dichloro-

이름 더 보기

3,4-디클로로카테콜

dichlorocatecholDICHLORO-1,2-BENZENEDIOLSCHEMBL693753,4-dichloro-1,2benzenediolorb1690548SCHEMBL294995393,4-Dichloro-benzene-1,2-diol3,4-Dichloro-1,2-benzenediol #

데이터베이스 식별자

CAS: 25167-85-5、3978-67-4
PubChem CID: 19877
DTXSID: DTXSID3073973
ChEBI: CHEBI:90882
EC Number: 690-118-4
Nikkaji: J79.895I

물성

구조 계산 물성

XLogP: 2.8
극성 표면적: 40.5 Å²
수소 결합 공여자 수: 2
수소 결합 수용자 수: 2
회전 가능 결합 수: 0
무거운 원자 수: 10
형식 전하: 0
복잡도: 120

물리화학적 성질

물리적 상태: Solid
색상: White to off-white
EPA: 3 · 3,4-Dichlorocatechol (3978-67-4)

안전 및 규제

GHS 분류

GHS Classification · 3건

This chemical does not meet GHS hazard criteria for 100% (3 of 3) of all reports.

Not Classified；Reported as not meeting GHS hazard criteria by 3 of 3 companies. For more detailed information, please visit ECHA C&L website.

Aggregated GHS information provided per 3 reports by companies from 1 notifications to the ECHA C&L Inventory.；Reported as not meeting GHS hazard criteria per 3 of 3 reports by companies.；There are 0 notifications provided by 0 of 3 reports by companies with hazard statement code(s).；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.