2-Bromo-4-(trifluoromethyl)benzaldehyde

HCID 3020373

노트 반응

부분 구조 검색 유사 구조 찾기

기본 정보

CAS: 85118-24-7
표준 SMILES: O=Cc1ccc(C(F)(F)F)cc1Br
InChIKey: CUKSTNNYAHZPRM-UHFFFAOYSA-N
분자식: C8H4BrF3O
평균 분자량: 253.02 g/mol
단동위원소 질량: 251.93976

이름 및 식별자

우선 이름: 2-Bromo-4-(trifluoromethyl)benzaldehyde
IUPAC: 2-bromo-4-(trifluoromethyl)benzaldehyde
영어명: 2-bromo-4-(trifluoromethyl)benzaldehyde
분자식: C8H4BrF3O
분자량: 253.02

이름 및 동의어

2-Bromo-4-(trifluoromethyl)benzaldehyde85118-24-7EINECS 285-677-2DTXSID00234247RefChem:85703DTXCID00156738285-677-2MFCD09835101Benzaldehyde, 2-bromo-4-(trifluoromethyl)-N94F74WA95SCHEMBL153259UNII-N94F74WA95

이름 더 보기

3-Bromo-4-formylbenzotrifluoride2-Amino-4-fluoro-6-methoxyacetophenone-bromo-4-(trifluoromethyl)benzaldehyde2-Bromo-4-(trifluoromethyl)benzaldehyde, 95+%

CL91182-Bromo-4-trifluoromethyl-benzaldehydeAKOS005063847AMY230602-bromo-4-trifluoromethylbenzaldehydeEBD9486362-Bromo-4-(trifluoromethyl)benzaldehyde;CS-W005029

데이터베이스 식별자

CAS: 85118-24-7
PubChem CID: 3020373
DTXSID: DTXSID00234247
UNII: N94F74WA95
EC Number: 285-677-2
Nikkaji: J309.744G

물성

구조 계산 물성

XLogP: 3
극성 표면적: 17.1 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 4
회전 가능 결합 수: 1
무거운 원자 수: 13
형식 전하: 0
복잡도: 192

물리화학적 성질

끓는 점: 230 · 230.0±40.0℃ (760 Torr)
밀도: 1.677 · 1.677±0.06 g/cm3 (20 ºC 760 Torr)
인화점: 92.9 · 92.9±27.3℃
저장 조건: 2 · under inert gas (nitrogen or Argon) at 2-8°C
물리적 상태: 액체
색상: Clear, faint yellow

안전 및 규제

GHS 분류

GHS Classification · 5건

Warning

H302 (75%): Harmful if swallowed [Warning Acute toxicity, oral]；H312 (25%): Harmful in contact with skin [Warning Acute toxicity, dermal]；H315 (75%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H332 (25%): Harmful if inhaled [Warning Acute toxicity, inhalation]；H335 (75%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]；H411 (25%): Toxic to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]

P261, P264, P264+P265, P270, P271, P273, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P391, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 4 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

유해성 정보

Hazard Classes and CategoriesAcute Tox. 4 (75%)；Acute Tox. 4 (25%)；Skin Irrit. 2 (75%)；Eye Irrit. 2 (100%)；Acute Tox. 4 (25%)；STOT SE 3 (75%)；Aquatic Chronic 2 (25%)