CAS 791642-68-7 4-Bromo-1-iodo-2-methoxybenzene (HCID 46835731)

기본 정보

CAS: 791642-68-7
표준 SMILES: COc1cc(Br)ccc1I
InChIKey: ZQPKPGBEEFOTEK-UHFFFAOYSA-N
분자식: C7H6BrIO
평균 분자량: 312.93 g/mol
단동위원소 질량: 311.86467

이름 및 식별자

우선 이름: 4-Bromo-1-iodo-2-methoxybenzene
IUPAC: 4-bromo-1-iodo-2-methoxybenzene
현지명: 4-브로모-1-요오도-2-메톡시벤젠
영어명: 4-bromo-1-iodo-2-methoxybenzene
분자식: C7H6BrIO
분자량: 312.93

이름 및 동의어

4-bromo-1-iodo-2-methoxybenzene791642-68-7DTXSID20676549RefChem:290491DTXCID20627298696-084-75-Bromo-2-iodoanisole4-Bromo-1-iodo-2-methoxy-benzeneMFCD118474825-Bromo-2-iodo-anisoleSCHEMBL2836741AKOS015851815

이름 더 보기

4-브로모-1-요오도-2-메톡시벤젠5-Bromo-2-iodoanisole97%5-Bromo-2-iodoanisole 97%Benzene, 4-broMo-1-iodo-2-Methoxy-4-bromo-1-iodo-2-methoxybenzene ISO 9001：2015 REACH4-Bromo-1-iodo-2-methoxybenzene, 5-Bromo-2-iodophenyl methyl ether

CS-W020552PS-7077SY035398AMY10797A9898SCHEMBL30016613FB464214-Bromo- 1- iodo- 2- methoxybenzene

데이터베이스 식별자

CAS: 791642-68-7
PubChem CID: 46835731
DTXSID: DTXSID20676549
EC Number: 696-084-7

물성

구조 계산 물성

XLogP: 3.2
극성 표면적: 9.2 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 1
회전 가능 결합 수: 1
무거운 원자 수: 10
형식 전하: 0
복잡도: 110

물리화학적 성질

녹는점: 37 °C · 37 °C
끓는 점: 161 · 161-162 °C(Press: 8 Torr)
밀도: 2.062 · 2.062±0.06 g/cm3(Predicted)
저장 조건: 2 · 2-8°C(protect from light)
물리적 상태: 결정성 분말
색상: 창백한 오렌지

안전 및 규제

GHS 분류

GHS Classification · 5건

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；H312 (66.7%): Harmful in contact with skin [Warning Acute toxicity, dermal]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H332 (66.7%): 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, 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.；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.