5-Bromo-2-hydroxybenzophenone

HCID 229009CAS 55082-33-2

기본 정보

표준 SMILES: O=C(c1ccccc1)c1cc(Br)ccc1O
InChIKey: IVIICRNXAGUXLR-UHFFFAOYSA-N
분자식: C13H9BrO2
평균 분자량: 277.11 g/mol
단동위원소 질량: 275.97859163

이름 및 식별자

우선 이름: 5-Bromo-2-hydroxybenzophenone
IUPAC: (5-bromo-2-hydroxyphenyl)-phenylmethanone
영어명: 5-BROMO-2-HYDROXYBENZOPHENONE
분자식: C13H9BrO2
분자량: 277.11

이름 및 동의어

5-Bromo-2-hydroxybenzophenoneDTXSID70281642RefChem:533256DTXCID30232796624-718-455082-33-2(5-bromo-2-hydroxyphenyl)(phenyl)methanone2-benzoyl-4-bromophenol(5-bromo-2-hydroxyphenyl)-phenylmethanoneMFCD00525062NSC22344(5-bromo-2-hydroxy-phenyl)-phenyl-methanone

이름 더 보기

5-Bromo-2-hydroxybenzophenone >(5-BROMO-2-HYDROXYPHENYL)(PHENYL)METHANONEJRH-05101, (5-Bromo-2-hydroxyphenyl)(phenyl)methanone, 97%

Methanone, (5-bromo-2-hydroxyphenyl)phenyl-ChemDiv2_000064Oprea1_723732SCHEMBL1453185-Bromo-2-hydroxy-benzophenoneSCHEMBL10532476SCHEMBL31172946IVIICRNXAGUXLR-UHFFFAOYSA-N

데이터베이스 식별자

CAS: 55082-33-2
PubChem CID: 229009
DTXSID: DTXSID70281642
EC Number: 624-718-4
Nikkaji: J2.215.094D

물성

구조 계산 물성

XLogP: 4
극성 표면적: 37.3 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 2
회전 가능 결합 수: 2
무거운 원자 수: 16
형식 전하: 0
복잡도: 248

물리화학적 성질

녹는점: 111 · 111-114 °C(lit.)
끓는 점: 365.5 · 365.5±27.0 °C(Predicted)
밀도: 1.521 · 1.521±0.06 g/cm3(Predicted)
산도 계수 (pKa): 7.37 · 7.37±0.43(Predicted)
물리적 상태: powder to crystal
색상: Light yellow to Yellow to Orange

안전 및 규제

GHS 분류

GHS Classification · 4건

Warning

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

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

Aggregated GHS information provided per 45 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.