4-브로모벤질아민

4-Bromobenzylamine

HCID 77571CAS 3959-07-7

부분 구조 검색 유사 구조 찾기

기본 정보

표준 SMILES: NCc1ccc(Br)cc1
InChIKey: XRNVSPDQTPVECU-UHFFFAOYSA-N
분자식: C7H8BrN
평균 분자량: 186.05 g/mol
단동위원소 질량: 184.98401136

이름 및 식별자

우선 이름: 4-Bromobenzylamine
IUPAC: (4-bromophenyl)methanamine
현지명: 4-브로모벤질아민
영어명: 4-Bromobenzylamine
분자식: C7H8BrN
분자량: 186.05

이름 및 동의어

4-Bromobenzylamine3959-07-74-BromobenzenemethanamineDTXSID70192704EINECS 223-559-4RefChem:520478DTXCID70115195223-559-4(4-Bromophenyl)methanaminep-BromobenzylamineBenzenemethanamine, 4-bromo-4-Bromo-benzylamine

이름 더 보기

4-브로모벤질아민OfBRETYLIUMThebretyliuMAURORA KA-7547RARECHEM AL BW 00254-Bromobenzylamine,99%4-BROMOBENZYLAMINE 99%4-Bromobenzylamine ,98%

1-(4-Bromophenyl)methanamineMFCD00047931p-BromobenzenemethanamineEN300-34927PZH4-bromobenzyl aminebenzylamine, 4-bromo-ZZB9N2KNT7

데이터베이스 식별자

CAS: 3959-07-7
PubChem CID: 77571
DTXSID: DTXSID70192704
ChEMBL: CHEMBL138621
UNII: ZZB9N2KNT7
EC Number: 223-559-4
Nikkaji: J191K

물성

구조 계산 물성

XLogP: 1.9
극성 표면적: 26 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 1
회전 가능 결합 수: 1
무거운 원자 수: 9
형식 전하: 0
복잡도: 77

물리화학적 성질

녹는점: 25 °C · 25 °C(lit.)
끓는 점: 110 · 110-112 °C30 mm Hg(lit.)
밀도: 1.473 g/mL · 1.473 g/mL at 25 °C(lit.)
굴절률: 1.5855 · 1.5855-1.5875
인화점: 230 °F · >230 °F
저장 조건: 2 · under inert gas (nitrogen or Argon) at 2–8 °C
물리적 상태: 액체
산도 계수 (pKa): 8.85 · 8.85±0.10(Predicted)
색상: 무색의
InChI: InChI=1S/C7H8BrN/c8-7-3-1-6(5-9)2-4-7/h1-4H,5,9H2
InChIKey: XRNVSPDQTPVECU-UHFFFAOYSA-N
SMILES: C1(CN)=CC=C(Br)C=C1
NIST: p-Bromobenzylamine(3959-07-7)

화학적 성질

clear colorless to light 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, P264, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P363, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 46 reports by companies from 4 notifications to the ECHA C&L Inventory.

유해성 정보

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

안전 데이터

wgk: 3
ridadr: UN 3259 8/PG 2
HS 번호: 29214990
risk_code: 34-21/22
hazard_code: C
safety_code: 26-28-36/37/39-45
포장분류: Ⅱ
위험 등급: 8
Hazard Classifications: Skin Corr. 1B
스토리지 클래스: 8A - Combustible corrosive hazardous materials

화학 및 산업

응용 분야 · 2건

용도4-Bromobenzylamine (p-Bromobenzylamine) may be used to synthesize 7-[(p-bromobenzyl)ureido]-7,8-dihydro-α-bisabolene.It may be used to synthesize the following 4-biphenylmethylamine derivatives:(4′-fluoro-4-biphenyl)methylamine(4′-methoxy-4-biphenyl)methylamine(2′-methoxy-4-biphenyl)methylamine(3′-cyano-4-biphenyl)methylamine

일반 설명4-Bromobenzylamine (BBA), also known as p-bromobenzylamine, is an aryl bromide. The selective formation of nitrile or imine from BBA in the presence of red copper has been reported. The formal [4+4] reaction of BBA to form 2,6,9-triazabicyclo[3.3.1]nonane derivatives has been investigated.

상·하류 제품 정보

상류 원료

에틸알코올 팔라듐 염산 수산화나트륨 염산 히드록실아민 4-브로모벤즈알데하이드 p-Bromobenzyl azide solution 2-(4-bromobenzyl)-1H-isoindole-1,3(2H)-dione N-(4-브로모페닐)포름아미드97 4-Bromobenzylamine hydrochloride 4-Bromobenzyl bromide 4-디메틸라미노벤질라민

하류 제품

N-(4-bromobenzyl)formamide 4-(Cbz-아미노메틸)페닐보론산 4-Aminomethylphenylboronic acid, pinacol ester, HCl AKOS BAR-2012

공급사50 곳

上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]

韶远科技（上海）有限公司021-50795510 4000665055 · [email protected]

科瑞迪化学400-821-5857 021-64326257 · [email protected]

上海将来实业股份有限公司400-0066400 13621662912 · [email protected]

上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]

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