Basic information
- CAS
205178-80-9- Standard SMILES
Cc1cc(C(=O)CBr)ccc1Cl- InChIKey
LUCPZLPBUCDKQE-UHFFFAOYSA-N- Molecular formula
- C9H8BrClO
- Average molar mass
- 247.51 g/mol
- Monoisotopic mass
- 245.94470466
Names & identifiers
- Preferred name
- 2-Bromo-1-(4-chloro-3-methylphenyl)ethanone
- IUPAC
- 2-bromo-1-(4-chloro-3-methylphenyl)ethanone
- English name
- 2-Bromo-1-(4-chloro-3-methylphenyl)ethan-1-one
- Molecular formula
- C9H8BrClO
- Molecular weight
- 247.52
Names & synonyms
205178-80-92-Bromo-1-(4-chloro-3-methylphenyl)ethanone2-BROMO-1-(4-CHLORO-3-METHYLPHENYL)ETHAN-1-ONE4-Chloro-3-methylphenacyl bromideMFCD00051586Ethanone, 2-bromo-1-(4-chloro-3-methylphenyl)-2-bromo-1-(4-chloro-3-methyl-phenyl)ethanoneSCHEMBL243504DTXSID00343868SBB051666AKOS015890716AC-9348
Show more names
2-Bromo-1-(4-chloro-methylphenyl)ethanon2-Bromo-1-(4-chloro-3-methylphenyl)ethan-1-one, 2-Bromo-4'chloro-3'-methylacetophenone
AS-6425CS-W0040222-bromo-4'-chloro-3'-methylacetophenoneBP-13237SY2831412-Bromo-1-(4-chloro-3-methyl-phenyl)-ethanone2-Bromo-1-(4-chloro-3-methylphenyl)ethanone #F064657
Database identifiers
- CAS
205178-80-9- PubChem CID
- 592802
- DTXSID
DTXSID00343868- EC Number
- 690-010-7
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 172
Physicochemical properties
- Melting point
- 56 °C · 56 °C
- Boiling point
- 312.3 · 312.3±27.0 °C(Predicted)
- Density
- 1.524 · 1.524±0.06 g/cm3 (20 ºC 760 Torr)
- storage temp.
- 2 · under inert gas (nitrogen or Argon) at 2-8°C
- Symbol(GHS)
- 5 · GHS05
- Signal word
- Danger
- Hazard statements
- 314 · H314
- Precautionary statements
- 260 · P260-P271-P280
- Hazard Codes
- C
- Risk Statements
- 36 · 36/37/38-34
- Safety Statements
- 26 · 26-36/37/39-45
- HS Code
- 2914790090 · 2914790090
Safety & regulation
GHS classification
GHS Classification
Danger
H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]
P260, P264, P264+P265, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P363, 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 CategoriesSkin Corr. 1B (100%)
Safety data
- hs_code
- 2914790090
- risk_code
- 36/37/38-34
- Signal word
- Danger
- Symbol(GHS)
- GHS05
- hazard_code
- C
- safety_code
- 26-36/37/39-45
- Hazard statements
- H314
- Precautionary statements
- P260-P271-P280
Chemistry & industry
Suppliers26 total
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
上海赫文斯化工有限公司15721252604 17321035817 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
上海恩诺生物科技有限公司+86 (21) 6435-5022
百科源(成都)科技有限公司15021461747 · [email protected]
赛默飞世尔科技（中国）有限公司800-810-5118 · [email protected]
赛纳斯特化学（欢迎点击联系）021-60343070
PT CHEM GROUP LIMITED+86-85511178; +86-85511178 · [email protected]
上海伯倚化工科技有限公司021-54096810 18017263450 · [email protected]
九鼎化学（上海）科技有限公司4009209199 · [email protected]
HANGZHOU LEAP CHEM CO., LTD.+86-571-87711850 +86-15355479329 · [email protected]
上海金源瑞医药科技有限公司021-18217523 18217523428 · [email protected]
上海思言生物科技有限公司021-50908862，442785678，326799392 18721037013 · [email protected]
南京博米尔生物科技有限公司025-83453382-8005 · [email protected]
上海特伯化学科技有限公司021-58170097 · [email protected]
上海相辉医药科技有限公司[email protected]
北京珐默兹医药科技有限公司15811073878 · [email protected]
杭州洁汉化工有限公司+86-571-86217390; +8618058761490 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 19370895928 · [email protected]
郑州汇聚化工有限公司037155153829 18003835034 · [email protected]
Alchem Pharmtech,Inc.8485655694 · [email protected]
济南思考化学有限公司0531-0000 · [email protected]
北京偶合科技有限公司13552068683 13522913783 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
Hefei TNJ Chemical Industry Co.,Ltd.+86-0551-65418684 +86-18949823763 · [email protected]
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
Related reactions
3 records
Compound notes
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