1-(Bromomethyl)-3-fluoro-5-nitrobenzene

HCID 64770545

노트 반응

부분 구조 검색 유사 구조 찾기

기본 정보

CAS: 883987-75-5
표준 SMILES: O=[N+]([O-])c1cc(F)cc(CBr)c1
InChIKey: PKGNYGZIPJHZPG-UHFFFAOYSA-N
분자식: C7H5BrFNO2
평균 분자량: 234.02 g/mol
단동위원소 질량: 232.94877

이름 및 식별자

우선 이름: 1-(Bromomethyl)-3-fluoro-5-nitrobenzene
IUPAC: 1-(bromomethyl)-3-fluoro-5-nitrobenzene
영어명: 3-Fluoro-5-nitrobenzyl bromide
분자식: C7H5BrFNO2
분자량: 234.02

이름 및 동의어

883987-75-51-(bromomethyl)-3-fluoro-5-nitrobenzeneRefChem:427288969-852-73-fluoro-5-nitrobenzyl bromideMFCD131856233-fluoro-5-nitrobenzylbromideBenzene, 1-(bromomethyl)-3-fluoro-5-nitro-SCHEMBL1098949PKGNYGZIPJHZPG-UHFFFAOYSA-NIKB98775AKOS014098893

이름 더 보기

AT11185PS-98581-(bromomethyl)-3-fluoro-5-nitro-benzeneDB-294280F836487

데이터베이스 식별자

CAS: 883987-75-5
PubChem CID: 64770545
EC Number: 969-852-7

물성

구조 계산 물성

XLogP: 2.4
극성 표면적: 45.8 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 3
회전 가능 결합 수: 1
무거운 원자 수: 12
형식 전하: 0
복잡도: 173

물리화학적 성질

물리적 상태: 결정질 고체
색상: Pale khaki lemon to faint tan, mushy

안전 및 규제

GHS 분류

GHS Classification · 5건

Danger

H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P260, P261, P264, P271, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P319, P321, 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.；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.