Methyl 3-(2-bromoethoxy)benzoate

HCID 10491483

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부분 구조 검색 유사 구조 찾기

기본 정보

CAS: 59516-96-0
표준 SMILES: COC(=O)c1cccc(OCCBr)c1
InChIKey: CGGLKWTURIUCMN-UHFFFAOYSA-N
분자식: C10H11BrO3
평균 분자량: 259.1 g/mol
단동위원소 질량: 257.98916

이름 및 식별자

우선 이름: Methyl 3-(2-bromoethoxy)benzoate
IUPAC: methyl 3-(2-bromoethoxy)benzoate
영어명: METHYL 3-(2-BROMOETHOXY)BENZENECARBOXYLATE
분자식: C10H11BrO3
분자량: 259.1

이름 및 동의어

Methyl 3-(2-bromoethoxy)benzoate59516-96-0DTXSID00440826RefChem:354631DTXCID60391648676-637-9Methyl 3-(2-bromoethoxy)benzenecarboxylateMFCD062040413-(2-bromo-ethoxy)-benzoic acid methyl esterSCHEMBL1606555CGGLKWTURIUCMN-UHFFFAOYSA-Nmethyl 3-(2-bromoethoxy)-benzoate

이름 더 보기

RARECHEM AL BF 1113Methyl 3-(2-broMoethoxy)benzoate, 97+%Benzoic acid,3-(2-bromoethoxy)-, methyl ester

JCA51696methyl 3-(2-bromoethyloxy)benzoateSBB102130AKOS005072777GA-08401-Bromo-2-(3'-carbomethoxyphenoxy)ethaneCS-0251555EN300-55183

데이터베이스 식별자

CAS: 59516-96-0
PubChem CID: 10491483
DTXSID: DTXSID00440826
EC Number: 676-637-9

물성

구조 계산 물성

XLogP: 3
극성 표면적: 35.5 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 3
회전 가능 결합 수: 5
무거운 원자 수: 14
형식 전하: 0
복잡도: 184

물리화학적 성질

끓는 점: 110 · 110/0.038mm
밀도: 1.431 · 1.431±0.06 g/cm3(Predicted)

안전 및 규제

GHS 분류

GHS Classification · 5건

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

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

Aggregated GHS information provided per 5 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.