기본 정보
- 표준 SMILES
COc1ccc(Cl)cc1Cl- InChIKey
CICQUFBZCADHHX-UHFFFAOYSA-N- 분자식
- C7H6Cl2O
- 평균 분자량
- 177.02 g/mol
- 단동위원소 질량
- 175.9795702
이름 및 식별자
- 우선 이름
- 2,4-Dichloroanisole
- IUPAC
- 2,4-dichloro-1-methoxybenzene
- 현지명
- (디클로로메톡시)벤젠
- 영어명
- (Dichloromethoxy)benzene
- 분자식
- C7H6Cl2O
- 분자량
- 177.03
이름 및 동의어
이름 더 보기
데이터베이스 식별자
- CAS
54518-15-9、553-82-2- PubChem CID
- 11119
- DTXSID
DTXSID4060286- ChEMBL
CHEMBL2272438- UNII
- 8T0V1CKB37
- EC Number
- 209-051-5
- Nikkaji
- J151.100I
물성
구조 계산 물성
- XLogP
- 3.3
- 극성 표면적
- 9.2 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 1
- 회전 가능 결합 수
- 1
- 무거운 원자 수
- 10
- 형식 전하
- 0
- 복잡도
- 108
실험 및 물리화학적 성질
Kovats Retention Index
1256;1253;1263;1269;1265;1272;1282;1250;1249;1257.6
1299.9
1857;1868;1869;1885;1902;1905
물리화학적 성질
- EPA
- Dichloroanisole (54518-15-9)
안전 및 규제
GHS 분류
GHS Classification
This chemical does not meet GHS hazard criteria for 33.3% (1 of 3) of reports.
Warning
H302 (33.3%): Harmful if swallowed [Warning Acute toxicity, oral];H315 (66.7%): Causes skin irritation [Warning Skin corrosion/irritation];H319 (66.7%): Causes serious eye irritation [Warning Serious eye damage/eye irritation];H332 (33.3%): Harmful if inhaled [Warning Acute toxicity, inhalation];H335 (66.7%): 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, 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 3 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.;Reported as not meeting GHS hazard criteria per 1 of 3 reports by companies.;There are 2 notifications provided by 2 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.
유해성 정보
화학 및 산업
용도 및 제조
공급사50 곳
관련 반응
연결된 노트
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