Basic information
- CAS
138505-25-6- Standard SMILES
CC(C)Oc1ccc(Br)cc1C=O- InChIKey
GRLHVQABEZCTRD-UHFFFAOYSA-N- Molecular formula
- C10H11BrO2
- Average molar mass
- 243.1 g/mol
- Monoisotopic mass
- 241.99424169
Names & identifiers
- Preferred name
- 5-Bromo-2-isopropoxybenzaldehyde
- IUPAC
- 5-bromo-2-propan-2-yloxybenzaldehyde
- English name
- 5-BROMO-2-ISOPROPOXYBENZALDEHYDE
- Molecular formula
- C10H11BrO2
- Molecular weight
- 243.1
Names & synonyms
5-bromo-2-isopropoxybenzaldehyde138505-25-6DTXSID30356143RefChem:301682DTXCID40307202Benzaldehyde, 5-bromo-2-(1-methylethoxy)-5-bromo-2-propan-2-yloxybenzaldehydeMFCD022574375-bromo-2-(methylethoxy)benzaldehyde5-bromo-2-(propan-2-yloxy)benzaldehyde5-Bromo-2-isopropoxy-benzaldehydeSCHEMBL177142
Show more names
5-bromo-2-propan-2-yloxy-benzaldehyde5-Bromo-2-(1-methylethoxy)benzaldehyde
GRLHVQABEZCTRD-UHFFFAOYSA-NALBB-001275BBL013915SBB020106STK346977AKOS000113397DS-10533SY082663
Database identifiers
- CAS
138505-25-6- PubChem CID
- 819973
- DTXSID
DTXSID30356143
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 170
Physicochemical properties
- Melting point
- 31 · 31-33 °C
- Boiling point
- 309.7 · 309.7±22.0 °C(Predicted)
- Density
- 1.391 · 1.391±0.06 g/cm3(Predicted)
- storage temp.
- 2 · under inert gas (nitrogen or Argon) at 2-8°C
- Appearance
- 33 °C · Colorless to light yellow 33°C Oil
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers26 total
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
Aladdin Scientific[email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
上海瀚鸿科技股份有限公司021-54306202 13764082696 · [email protected]
无锡丽恒昇生物医药科技有限公司15250805028 15250805028 · [email protected]
河南利恩化工产品有限公司0371-63357898 15378766539 · [email protected]
上海珂华生物科技有限公司021-60455363 18019463053 · [email protected]
上海毕得医药科技股份有限公司400-164-7117 18317119277 · [email protected]
河南东元化工科技有限公司16696119288 · [email protected]
南京代盟化工有限公司025-66800956 18800000000 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
聊城莱博特生物医药科技有限公司0635-893290 · [email protected]
上海尊理加生命科技有限公司021-34045219 13062664914 · [email protected]
江苏艾康生物医药研发有限公司025-66061636 19370895928 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 400821072 · [email protected]
上海吉至生化科技有限公司021-4009004166/18616739031 18616739031 · [email protected]
河南利恩化工产品有限公司03716091-9097 13383857418 · [email protected]
上海肯恩化学科技有限公司13701870891; 02152215958 · [email protected]
Alchem Pharmtech,Inc.8485655694 · [email protected]
河北药成医药科技有限责任公司19903117580 19903117510 · [email protected]
烟台盛凯伦化学科技有限公司开发区第一分公司13356901049 · [email protected]
合肥丽巴奥物理化学科技有限公司+1-5184799099 · [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]
陕西缔都化学有限公司17691182729 17392216275 · [email protected]
Related reactions
16 records
Compound notes
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