Basic information
- CAS
37885-41-9- Standard SMILES
CCC(=O)c1ccc(Cl)cc1Cl- InChIKey
FBMTWRZQBRHOPF-UHFFFAOYSA-N- Molecular formula
- C9H8Cl2O
- Average molar mass
- 203.06 g/mol
- Monoisotopic mass
- 201.99522024
Names & identifiers
- Preferred name
- 2',4'-Dichloropropiophenone
- IUPAC
- 1-(2,4-dichlorophenyl)propan-1-one
- English name
- 2',4'-Dichloropropiophenone
- Molecular formula
- C9H8Cl2O
- Molecular weight
- 203.07
Names & synonyms
2',4'-Dichloropropiophenone1-(2,4-DICHLOROPHENYL)-1-PROPANONE1-Propanone, 1-(2,4-dichlorophenyl)-PQX59H9QPVEINECS 253-700-5DTXSID00191321RefChem:80108DTXCID10113812253-700-537885-41-91-(2,4-dichlorophenyl)propan-1-one2,4-Dichloropropiophenone
Show more names
2',4'-Dichloropropiophenone>2,4-Dichlorophenyl)-1-propanone1-(2,4-DICHLOROPHENYL)-1-PROPANONE 95%1-(2,4-Dichlorophenyl)-1-propanone,95%1-(2,4-Dichlorophenyl)-1-propanone,97%
MFCD00027396D3937UNII-PQX59H9QPVFT-0610073SCHEMBL1144066SCHEMBL4773316SCHEMBL29712843MBA88541
Database identifiers
- CAS
37885-41-9- PubChem CID
- 123467
- DTXSID
DTXSID00191321- UNII
- PQX59H9QPV
- EC Number
- 253-700-5
- Nikkaji
- J261.262C
Properties
Computed structural properties
- XLogP
- 3.3
- 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
- 170
Physicochemical properties
- Boiling point
- 121 · 121-123°C 7mm
- Density
- 1 · 1,287 g/cm3
- refractive index
- 1.551 · 1.551-1.553
- Flash point
- 110 °C · >110°C
- storage temp.
- Sealed in dry,Room Temperature
- form
- powder to lump
- color
- White to Light yellow
- Water Solubility
- Slightly soluble in water
- BRN
- 2248270 · 2248270
- InChI
- InChI=1S/C9H8Cl2O/c1-2-9(12)7-4-3-6(10)5-8(7)11/h3-5H,2H2,1H3
- InChIKey
- FBMTWRZQBRHOPF-UHFFFAOYSA-N
- SMILES
- C(C1=CC=C(Cl)C=C1Cl)(=O)CC
- CAS DataBase Reference
- 37885 · 37885-41-9(CAS DataBase Reference)
- FDA UNII
- 59 H9QPV · PQX59H9QPV
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 261 · P261-P280a-P304+P340-P305+P351+P338-P405-P501a-P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313
- Hazard Codes
- Xi
- Risk Statements
- 36 · 36/37/38
- Safety Statements
- 37 · 37/39-26
- HS Code
- 2914.79 · 2914.79.9000
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 (93.2%): 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 73 reports by companies from 3 notifications to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (93.2%)
Safety data
- hs_code
- 2914.79.9000
- risk_code
- 36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- safety_code
- 37/39-26
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P261-P280a-P304+P340-P305+P351+P338-P405-P501a-P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313
Chemistry & industry
Applications
Uses2',4'-Dichloropropiophenone is used in the synthesis of (S)-3-chloro-1-(4-chlorophenyl)-1-propanol.
Upstream & downstream products
Upstream raw materials
Suppliers82 total
国药集团化学试剂有限公司86-21-63210123 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
上海腾准生物科技有限公司19821570922 · [email protected]
温州共赢化学有限公司+86-0086-577-64498589 +86-15355981851 · [email protected]
普善实业（陕西）有限公司029-81310890 18165209495 · [email protected]
Hebei shuoxi biotechnology co. LTD+8613081092107
陕西缔都化学有限公司029-029-81123119 17391733320 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
上海辅欣医药科技有限公司+86-021-021-50872116 · [email protected]
武汉易泰科技有限公司上海分公司18930552037 · [email protected]
阿法埃莎（中国）化学有限公司400-6106006 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
Cangzhou Wanyou New Material Technology Co.,Ltd18631714998 · [email protected]
烟台盛凯伦生物制品有限公司13356901049 · [email protected]
河北缤享新材料科技有限公司+8618633865755 · [email protected]
上海钰康生物科技有限公司+86-18930848214 +86-021-56762820 · [email protected]
湖北广奥生物科技有限公司027-02702759223056 18162699093 · [email protected]
湖北魏氏化学试剂股份有限公司17771898297 13125137661 · [email protected]
河北茹麒科技有限公司176-03256889 17603256889 · [email protected]
Hebei Shengyuan Jinlong Import and Export Co. LTD+86-17367750398 · [email protected]
菏泽博纳医药科技有限公司15865805009 · [email protected]
江苏艾康生物医药研发有限公司025-66113011 13913916777 · [email protected]
苏州君叶生物医药科技有限公司0512-0512-53662086-8001 18913766772 · [email protected]
TCI AMERICA800-4238616 · [email protected]
TOKYO CHEMICAL INDUSTRY CO., LTD.03-36680489 · [email protected]
TCI Europe320-37350700 · [email protected]
陕西麟邦实业有限公司17709134430 · [email protected]
上海丽康新材料有限公司+86-16631818819 +86-17736933208 · [email protected]
Qingdao Dexin Chemical Co., Ltd+86-15553333686 · [email protected]
上海毕得医药科技股份有限公司400-164-7117 18317119277 · [email protected]
Hebei Yiduo Import and Export Co., Ltd.[email protected]
石家庄通洋进出口有限公司[email protected]
Hebei Runbin Biotechnology Co. LTD13180553332 · [email protected]
九鼎化学（上海）科技有限公司4009209199 · [email protected]
常州安奈凯医药科技有限公司+86-0519-8359-8696 · [email protected]
上海博熠生物医药科技有限公司021-021-54331997 18321536537 · [email protected]
湖北恒绿源科技有限公司027-88188016 18717196322 · [email protected]
HANGZHOU LEAP CHEM CO., LTD.+86-571-87711850 +86-15355479329 · [email protected]
上海阿拉丁生化科技股份有限公司6206333 13167063860 · [email protected]
河北方乾新材料科技有限公司86-180-3439-5858-5858 18034395858
南京艾比克斯生化科技有限公司025-87193546 18652950785 · [email protected]
上海源叶生物科技有限公司13636370518 · [email protected]
上海麦克林生化科技股份有限公司50706066 15221275939 · [email protected]
湖北齐飞医药化工有限公司027-59322506 18071128681 · [email protected]
山东西亚化学有限公司4009903999 13395398332 · [email protected]
烟台盛凯伦化学科技有限公司13356901049 · [email protected]
广州市金华大化学试剂有限公司020-84383047 · [email protected]
山东小野化学股份有限公司0539-6362799 20）
武汉弘德悦欣医药科技有限公司027-83850116 18164090116 · [email protected]
Related reactions
7 records
Compound notes
Loading…