Basic information
- CAS
55171-60-3- Standard SMILES
COc1ccc(C=O)c(Br)c1OC- InChIKey
BWFRHSRQIKGLLM-UHFFFAOYSA-N- Molecular formula
- C9H9BrO3
- Average molar mass
- 245.07 g/mol
- Monoisotopic mass
- 243.97350625
Names & identifiers
- Preferred name
- 2-Bromo-3,4-dimethoxybenzaldehyde
- IUPAC
- 2-bromo-3,4-dimethoxybenzaldehyde
- English name
- 2-Bromo-3,4-dimethoxybenzaldehyde
- Molecular formula
- C9H9BrO3
- Molecular weight
- 245.07
Names & synonyms
2-Bromo-3,4-dimethoxybenzaldehyde55171-60-3DTXSID80347167RefChem:256986DTXCID10298239966-116-72-BromoveratraldehydeMFCD077728962-bromoveratraldhydeo-bromoveratraldehydeSCHEMBL148284FCA17160
Show more names
2-bromo-3,4-dimethoxybenzylaldehyde2-Bromo-3,4-dimethoxybenzaldehyde #Benzaldehyde, 2-bromo-3,4-dimethoxy2-bromanyl-3,4-dimethoxy-benzaldehydeAKOS015996200Benzaldehyde, 2-bromo-3,4-dimethoxy-AS-77162SY126441
Database identifiers
- CAS
55171-60-3- PubChem CID
- 618538
- DTXSID
DTXSID80347167- EC Number
- 966-116-7
- Nikkaji
- J464.513H
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 174
Physicochemical properties
- Melting point
- 80 °C · 80 °C
- Boiling point
- 310 · 310.0±37.0 °C(Predicted)
- Density
- 1.482 · 1.482±0.06 g/cm3(Predicted)
- storage temp.
- Inert atmosphere,Room Temperature
- solubility
- Chloroform (Slightly), Methanol (Slightly)
- form
- Solid
- color
- White to Off-White
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P272, P280, 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)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
Chemistry & industry
Applications
UsesMeconin (M202900) intermediate.
Suppliers41 total
上海腾准生物科技有限公司19821570922 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
安徽合诺生物科技有限公司0555-2761852
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
宝鸡缔都医药化工有限公司029-81145305 17791533577 · [email protected]
上海宣月科技有限公司15216675652 · [email protected]
深圳法默科技有限公司0755-86648230 · [email protected]
深圳康特腾科技有限公司86-0755-86635001 · [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]
凯试（上海）科技有限公司021-50135380 · [email protected]
HANGZHOU LEAP CHEM CO., LTD.+86-571-87711850 +86-15355479329 · [email protected]
徐州睿诚致合生物医药技术有限公司15195955353 · [email protected]
苏州美石生物科技有限公司1173954148q · [email protected]
艾吉析科技（上海）有限公司17721401538;17717235263 17721401538 · [email protected]
北京伊万景瑞生物科技有限公司15866847540 · [email protected]
上海逐耀医药科技有限公司18321033991 · [email protected]
南京博米尔生物科技有限公司025-83453382-8005 · [email protected]
上海睿升化工科技有限公司15026594951 · [email protected]
河北美星化工有限公司155-11852758; 18408670720 · [email protected]
Shanghai Acmec Biochemical Technology Co., Ltd.+86-18621343501 · [email protected]
药明览博(武汉)化学科技有限公司022-59987777 13552403979 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 15955137747 · [email protected]
苏州美诺医药科技有限公司0512-69561983 13914027025 · [email protected]
上海吉至生化科技有限公司021-4009004166/18616739031 18616739031 · [email protected]
深圳聚合生化科技有限公司+86-400-002-6226 · [email protected]
济南睿思医药技术有限公司0531-0531-69900633 19963472814 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
上海凯为化学科技有限公司021-58461859 15821823057 · [email protected]
SHANGHAI KEAN TECHNOLOGY CO., LTD.+8613817748580 · [email protected]
Qingdao RENAS Polymer Material Co., Ltd.+86-0532-86867058 +86-18562606086 · [email protected]
合肥钼凯医药科技有限公司18130062233 · [email protected]
陕西国槐硕海医药科技有限公司029-13279368192 13279368192 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
陕西缔都医药化工有限公司+86-29-87569266 +86-17392581500 · [email protected]
湖北偕丰医药科技有限公司2383948258 19172820304 · [email protected]
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
河南威梯希化工科技有限公司0371-55135753 18003832934 · [email protected]
Related reactions
6 records
Compound notes
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