4-Bromo-2-{[(3,5-dichlorophenyl)imino]methyl}phenol

HCID 710164CAS 303759-09-3

기본 정보

표준 SMILES: Oc1ccc(Br)cc1C=Nc1cc(Cl)cc(Cl)c1
InChIKey: UHGJKERLQDVILY-UHFFFAOYSA-N
분자식: C13H8BrCl2NO
평균 분자량: 345 g/mol

이름 및 식별자

우선 이름: 4-Bromo-2-{[(3,5-dichlorophenyl)imino]methyl}phenol
IUPAC: 4-bromo-2-[(3,5-dichlorophenyl)iminomethyl]phenol
영어명: 4-bromo-2-{[(3,5-dichlorophenyl)imino]methyl}phenol
분자식: C13H8BrCl2NO
분자량: 345.02

이름 및 동의어

303759-09-34-bromo-2-{[(3,5-dichlorophenyl)imino]methyl}phenol4-bromo-2-{(E)-[(3,5-dichlorophenyl)imino]methyl}phenol4-bromo-2-[(3,5-dichlorophenyl)iminomethyl]phenol(E)-4-bromo-2-(((3,5-dichlorophenyl)imino)methyl)phenol2-[(1E)-2-(3,5-dichlorophenyl)-2-azavinyl]-4-bromophenol4-Bromo-2-(((3,5-dichlorophenyl)imino)methyl)phenolSCHEMBL329959SCHEMBL329960SCHEMBL30342888UHGJKERLQDVILY-UHFFFAOYSA-NMFCD00813193

이름 더 보기

Phenol, 4-bromo-2-[[(3,5-dichlorophenyl)imino]methyl]-

STK044535(6E)-4-bromo-6-[(3,5-dichloroanilino)methylidene]cyclohexa-2,4-dien-1-oneAKOS000484086BS-10482ST010323CS-0333237AN-329/113782223,5-dichloro-N-(5-bromo-2-hydroxybenzylidene)aniline

데이터베이스 식별자

CAS: 303759-09-3
PubChem CID: 710164
EC Number: 167-314-9

물성

구조 계산 물성

XLogP: 4.8
극성 표면적: 32.6 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 2
회전 가능 결합 수: 2
무거운 원자 수: 18
형식 전하: 0
복잡도: 293

물리화학적 성질

끓는 점: 477.1 · 477.1±45.0 °C(Predicted)
밀도: 1.58 · 1.58±0.1 g/cm3(Predicted)
산도 계수 (pKa): 7.51 · 7.51±0.43(Predicted)

안전 및 규제

GHS 분류

GHS Classification · 4건

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P271, P273, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P391, P403+P233, P405, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.