4-Bromobenzene-1,2-diamine (HCID 323593)

이름 및 식별자

우선 이름: 4-Bromobenzene-1,2-diamine
IUPAC: 4-bromobenzene-1,2-diamine
영어명: 4-Bromo-1,2-benzenediamine
분자식: C6H7BrN2
분자량: 187.04

이름 및 동의어

4-bromobenzene-1,2-diamine1,2-Benzenediamine, 4-bromo-DTXSID80314531RefChem:520458DTXCID20265654629-615-81575-37-74-Bromo-1,2-benzenediamine4-Bromo-1,2-diaminobenzene1,2-Diamino-4-bromobenzene4-Bromo-o-phenylenediamine2-Amino-4-bromoaniline

이름 더 보기

3-BROMO-1,2-DIAMINOBENZENE4-BroMo-12-benzenediaMineBUTTPARK 95\04-564-Bromo-o-phenyleOliceridine Impurity 12

4-Bromo-1,2-phenylenediamineMFCD026606222-amino-4-bromophenylamineUKC7FT8YHS4-Bromo-2-aminoanilineNSC-2851103,4-Diaminobromobenzene4-Bromo-benzene-1,2-diamine

데이터베이스 식별자

CAS: 1575-37-7
PubChem CID: 323593
DTXSID: DTXSID80314531
UNII: UKC7FT8YHS
EC Number: 629-615-8
Nikkaji: J80.240I

물성

구조 계산 물성

XLogP: 1.3
극성 표면적: 52 Å²
수소 결합 공여자 수: 2
수소 결합 수용자 수: 2
회전 가능 결합 수: 0
무거운 원자 수: 9
형식 전하: 0
복잡도: 97.1

물리화학적 성질

녹는점: 65 · 65-69 °C (dec.)(lit.)
끓는 점: 289.3 · 289.3±20.0 °C(Predicted)
밀도: 1.697 · 1.697±0.06 g/cm3(Predicted)
저장 조건: Keep in dark place,Sealed in dry,Room Temperature
용해도: 클로로포름에 용해됩니다.
물리적 상태: powder to crystal
산도 계수 (pKa): 3.46 · 3.46±0.10(Predicted)
색상: 흰색에서 갈색으로
InChI: InChI=1S/C6H7BrN2/c7-4-1-2-5(8)6(9)3-4/h1-3H,8-9H2
InChIKey: WIHHVKUARKTSBU-UHFFFAOYSA-N
SMILES: C1(N)=CC=C(Br)C=C1N

화학적 성질

White solid

안전 및 규제

GHS 분류

GHS Classification · 5건

This chemical does not meet GHS hazard criteria for 1.8% (1 of 55) of reports.

Danger

H301 (83.6%): Toxic if swallowed [Danger Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P272, P280, P301+P316, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P333+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 55 reports by companies from 10 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Regulatory Information · 2건

Status: Active Update: 28-11-2014 https://echa.europa.eu/registration-dossier/-/registered-dossier/7523

1,2-Benzenediamine, 4-bromo-: Does not have an individual approval but may be used under an appropriate group standard

Hazard Classes and CategoriesAcute Tox. 3 (83.6%)

안전 데이터

wgk: 3
ridadr: UN 2811 6.1/PG 3
HS 번호: 29215110
risk_code: 25-36/38-43
hazard_code: T
safety_code: 26-36/37-45
포장분류: III
위험 등급: 6.1
위험 참고 사항: Toxic
Hazard Classifications: Acute Tox. 3 OralEye Irrit. 2Skin Irrit. 2Skin Sens. 1
스토리지 클래스: 6.1C - Combustible acute toxic Cat.3toxic compounds or compounds which causing chronic effects

화학 및 산업

응용 분야

용도4-Bromo-o-phenylenediamine, is used as an important raw material and intermediate used in organic Synthesis, pharmaceuticals, agrochemicals and dyestuff.

일반 설명4-Bromo-1,2-diaminobenzene can be obtained from 1,2-diaminobenzene via acetylation followed by bromination and alkaline hydrolysis.