플로로벤질브로마이드

alpha-Bromo-o-fluorotoluene

HCID 67968CAS 446-48-0

부분 구조 검색 유사 구조 찾기

기본 정보

표준 SMILES: Fc1ccccc1CBr
InChIKey: FFWQLZFIMNTUCZ-UHFFFAOYSA-N
분자식: C7H6BrF
평균 분자량: 189.02 g/mol
단동위원소 질량: 187.96369051

이름 및 식별자

우선 이름: alpha-Bromo-o-fluorotoluene
IUPAC: 1-(bromomethyl)-2-fluorobenzene
현지명: 플로로벤질브로마이드
영어명: 2-Fluorobenzyl bromide
분자식: C7H6BrF
분자량: 189.02

이름 및 동의어

2-Fluorobenzyl bromide446-48-0alpha-Bromo-o-fluorotolueneBenzene, 1-(bromomethyl)-2-fluoro-EINECS 207-169-1DTXSID50196240RefChem:555413DTXCID60118731207-169-11-(Bromomethyl)-2-fluorobenzeneo-Fluorobenzyl bromide2-fluorobenzylbromide

이름 더 보기

플로로벤질브로마이드2-플루오로벤질 브로마이드1-(BROMOMETHYL)-2-FLUORO-BENZENE2-Fluorobenzyl bromi2-Fluarobenzyl bromideà-bromo-2-fluorotolueneα-Bromo-2-fluorotoluene2-FluorobenzylBromide>2-Fluorobenzylbromide,98%2- fluorinebenzyl broMide

MFCD000003242-Fluoro-benzyl bromide1-bromomethyl-2-fluorobenzene1-Fluoro-2-(bromomethyl)benzene2-fluoro-benzylbromide2-fluorobenzyl-bromideorthofluorobenzyl bromide2-fluoro benzyl bromide

데이터베이스 식별자

CAS: 446-48-0
PubChem CID: 67968
DTXSID: DTXSID50196240
UNII: R66VUL5SDN
EC Number: 207-169-1
Nikkaji: J31.785C

물성

구조 계산 물성

XLogP: 2.8
극성 표면적: 0 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 1
회전 가능 결합 수: 1
무거운 원자 수: 9
형식 전하: 0
복잡도: 85

물리화학적 성질

끓는 점: 84 · 84-85 °C15 mm Hg(lit.)
밀도: 1.567 g/mL · 1.567 g/mL at 25 °C(lit.)
굴절률: 20 · n20/D 1.552(lit.)
인화점: 181 °F · 181 °F
저장 조건: 2 · under inert gas (nitrogen or Argon) at 2-8°C
용해도: 클로로포름(약간 용해됨), 메탄올(약간 용해됨)
물리적 상태: 액체
Specific Gravity: 1.567 · 1.567
색상: 무색투명~미황색
BRN: 1099894 · 1099894
InChI: InChI=1S/C7H6BrF/c8-5-6-3-1-2-4-7(6)9/h1-4H,5H2
InChIKey: FFWQLZFIMNTUCZ-UHFFFAOYSA-N
SMILES: C1(CBr)=CC=CC=C1F
NIST: 2 · 2-Fluorobenzyl bromide(446-48-0)

화학적 성질

clear colorless to slightly yellow liquid

안전 및 규제

GHS 분류

GHS Classification · 4건

Danger

H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/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 52 reports by companies from 11 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Regulatory InformationBenzene, 1-(bromomethyl)-2-fluoro-: Does not have an individual approval but may be used under an appropriate group standard

Hazard Classes and CategoriesSkin Corr. 1B (100%)

안전 데이터

wgk: 3
ridadr: UN 3265 8/PG 2
HS 번호: 29039990
risk_code: 34-36/37
hazard_code: C
safety_code: 23-26-27-36/37/39-45
포장분류: III
위험 등급: 8
위험 참고 사항: Corrosive/Lachrymatory
Hazard Classifications: Skin Corr. 1BSTOT SE 3
스토리지 클래스: 8A - Combustible corrosive hazardous materials

화학 및 산업

응용 분야

용도2-Fluorobenzyl bromide was used:in the synthesis of 2-pyrrolo[2,3-d]pyrimidinesas alkylating agent during the synthesis of 8-alkylated imidazolo[1,2-a]pyrimid-5-onesin the synthesis of prasugrel

상·하류 제품 정보

하류 제품

(2-Fluoro-phenyl)-methanesulfonyl chloride Ethyl 2-fluorophenylacetate 2-브로모메틸-1-플루오로-4-니트로벤젠 사이클로프로필2-플루오로벤질케톤 2-Fluoro-DL-phenylalanine (2-Fluoro-benzyl)-hydrazine 1-(2-fluorobenzyl)piperidin-4-ol N-벤질-2-플루오로-N-메틸벤질라광산 Benzenemethanamine, 2-fluoro-N-[(4-fluorophenyl)methyl]-N-methyl-2-플루오로벤질메틸설폰 1-[(2-플루오로페닐)메틸]-1H-인돌-2,3-디온 Benzene, 2-chloro-1-[(2-fluorophenyl)methoxy]-4-nitro-

공급사50 곳

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