기본 정보
- CAS
32454-35-6- 표준 SMILES
CC(C)(C(=O)O)c1ccc(Br)cc1- InChIKey
AKVOQXBQLXOEEF-UHFFFAOYSA-N- 분자식
- C10H11BrO2
- 평균 분자량
- 243.1 g/mol
- 단동위원소 질량
- 241.99424169
이름 및 식별자
- 우선 이름
- 2-(4-Bromophenyl)-2-methylpropanoic acid
- IUPAC
- 2-(4-bromophenyl)-2-methylpropanoic acid
- 현지명
- 2-(4-브로모페닐)-2-메틸프로피온산
- 영어명
- 2-(4-Bromophenyl)-2-methylpropionic acid
- 분자식
- C10H11BrO2
- 분자량
- 243.1
이름 및 동의어
2-(4-bromophenyl)-2-methylpropanoic acid32454-35-6EC 696-555-7DTXSID70448899RefChem:84349DTXCID60399720696-555-72-(4-Bromophenyl)-2-methylpropionic acidMFCD026842202-(4-Bromophenyl)-2,2'-dimethylacetic AcidSCHEMBL897098CS-M1477
이름 더 보기
2-(4-브로모페닐)-2-메틸프로피온산Bilastine Impurity 772-(4-Bromophenyl)-2-methylpropi2-(4-Bromophenyl)-2-methylpropinicacid2-(4-bromophenyl)-2-methylpropanoicaci2-Methyl-2-(p-bromphenyl)propionic acidP-Bromo a,a-Dimethyl Phenyl Acetic Acid2-(4-Bromophenyl)-2,2dimethylacetic Acid2-Methyl-2-(P-Bromophenyl)Propionic Acid
TS-033772-(4-bromophenyl)-2,2-dimethylacetic acidB62022-Methyl-2-(4-bromophenyl)propionic acidBCP141182-(4-bromo-AKVOQXBQLXOEEF-UHFFFAOYSA-NDimethyl(p-bromophenyl)acetic Acid
데이터베이스 식별자
- CAS
32454-35-6- PubChem CID
- 10933679
- DTXSID
DTXSID70448899- EC Number
- 696-555-7
물성
구조 계산 물성
- XLogP
- 3
- 극성 표면적
- 37.3 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 2
- 회전 가능 결합 수
- 2
- 무거운 원자 수
- 13
- 형식 전하
- 0
- 복잡도
- 193
물리화학적 성질
- 녹는점
- 122 · 122-124°C
- 끓는 점
- 334.2 · 334.2±17.0 °C(Predicted)
- 밀도
- 1.456 · 1.456±0.06 g/cm3(Predicted)
- 저장 조건
- Sealed in dry,Room Temperature
- 용해도
- 디클로로메탄, 에틸아세테이트, 메탄올에 용해됨
- 물리적 상태
- 고체
- 산도 계수 (pKa)
- 4.26 · 4.26±0.10(Predicted)
- 색상
- 하얀색
- InChI
- InChI=1S/C10H11BrO2/c1-10(2,9(12)13)7-3-5-8(11)6-4-7/h3-6H,1-2H3,(H,12,13)
- InChIKey
- AKVOQXBQLXOEEF-UHFFFAOYSA-N
- SMILES
- C(C)(C)(C(=O)O)C1=CC=C(Br)C=C1
화학적 성질
White Solid
안전 및 규제
GHS 분류
GHS Classification
This chemical does not meet GHS hazard criteria for 2.4% (1 of 41) of reports.
Warning
H302 (95.1%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P270, P301+P317, P330, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 41 reports by companies from 4 notifications to the ECHA C&L Inventory.
유해성 정보
Regulatory InformationStatus: Active Update: 26-03-2013 https://echa.europa.eu/registration-dossier/-/registered-dossier/8039
Hazard Classes and CategoriesAcute Tox. 4 (95.1%)
안전 데이터
- HS 번호
- 2918999090
- risk_code
- 22
- hazard_code
- Xn
화학 및 산업
상·하류 제품 정보
상류 원료
하류 제품
공급사100 곳
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
苏州启航生物科技有限公司18151111370 · [email protected]
山东鑫道医药科技有限公司0546-5612566 18019700392 · [email protected]
上海泰矶林实业有限公司02150630626 17717886015 · [email protected]
河北展药生物科技有限公司15369953316 +8615369953316 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
江苏华伟斯特医药科技有限公司0519-88721112
上海将来实业股份有限公司400-0066400 13621662912 · [email protected]
南通萧畅医药贸易有限公司0513-82104991 18862997351 · [email protected]
芷威(上海)化学科技有限公司021-20221225 13917446399 · [email protected]
Allfluoro Pharmaceutical Company Limited+86-400-0216110 +86-15958047586 · [email protected]
成都添福瑞生物科技有限公司18030648795 18030648795 · [email protected]
常州科化生物科技有限公司0519-68985668 13685222090 · [email protected]
浙江雅辰药物科技股份有限公司13674959855 13674959855 · [email protected]
南京圣亿来化工有限公司19951936396 · [email protected]
上海源鼎化学科技有限公司21-57721279 18121011378 · [email protected]
嘉兴市艾森化工有限公司0573-85285100 18627885956 · [email protected]
郑州药领医药科技有限公司13526569071 · [email protected]
安徽德信佳生物医药有限公司0531-82375818 15064153060 · [email protected]
武汉丰泰威远科技有限公司+86-27-8746-5837 +86-18627785180 · [email protected]
武汉丰泰威远科技有限公司027-87465837 19945049750 · [email protected]
孝感深远化工有限公司15527621225; 15527621225 · [email protected]
苏州施亚生物科技有限公司86(512)5235 8471 17715136450 · [email protected]
南京维奥化工有限公司Please Send Email 18652950785 · [email protected]
西安瑞联新材料股份有限公司029-68669089-8816
上海特伯化学科技有限公司+86-21-60341587 · [email protected]
TOKYO CHEMICAL INDUSTRY CO., LTD.03-36680489 · [email protected]
TCI Europe320-37350700 · [email protected]
上海贤鼎生物科技有限公司4009209199 · [email protected]
深圳康特腾科技有限公司86-0755-86635001 · [email protected]
上海睿升化工科技有限公司+86-021-50935922
上海宸香医药科技有限公司021-20960837 · [email protected]
上海将来实业股份有限公司400-0066400 13621662912 · [email protected]
上海毕得医药科技股份有限公司400-164-7117 18317119277 · [email protected]
上海乐济生化科技有限公司+86-21-51762186 · [email protected]
Labnetwork lnc.+86-27-50766799 +86-18062016861 · [email protected]
郑州萃智医药科技有限公司19943855286 · [email protected]
南京恩德萨生物科技有限公司025-58862853 18915922038 · [email protected]
南京多隆生物科技有限公司18905173768 · [email protected]
南京恰风和医药科技有限公司025-57018978 18251899859 · [email protected]
上海孚一生物科技有限公司+86 (21) 61124340
凯试(上海)科技有限公司021-50135380 · [email protected]
Changzhou Fullone Chemical Co., Ltd.+86-13328197671 +86-13861172460 · [email protected]
池州凯隆进出口贸易有限公司[email protected]
吉林中科研伸科技有限公司0431-80534353 19917294565 · [email protected]
AN PharmaTech Co Ltd86(21)68097365 · [email protected]
上海皓之翔生物科技有限公司(原上海拓青化工有限公司)526763801 13301653310 · [email protected]
斯派螺(武汉)药物研发有限公司[email protected]
绵阳万迪诺医药科技有限公司15861805752,15681201579 18727934995
관련 반응
23건
화합물 노트
불러오는 중…