Basic information
- CAS
203915-49-5- Standard SMILES
O=[N+]([O-])c1c(Cl)ccc(C(F)(F)F)c1Cl- InChIKey
DIMKVPKLQUPPFN-UHFFFAOYSA-N- Molecular formula
- C7H2Cl2F3NO2
- Average molar mass
- 259.99 g/mol
- Monoisotopic mass
- 258.9414682
Names & identifiers
- Preferred name
- 2,4-Dichloro-3-nitrobenzotrifluoride
- IUPAC
- 1,3-dichloro-2-nitro-4-(trifluoromethyl)benzene
- English name
- 2,4-Dichloro-3-nitrobenzotrifluoride
- Molecular formula
- C7H2Cl2F3NO2
- Molecular weight
- 260
Names & synonyms
2,4-Dichloro-3-nitrobenzotrifluoride203915-49-51,3-dichloro-2-nitro-4-(trifluoromethyl)benzeneMFCD00153114Benzene, 1,3-dichloro-2-nitro-4-(trifluoromethyl)-SCHEMBL374327SCHEMBL29763615DTXSID20371643SBB1022432,4-dichloro-3-nitro-benzotrifluorid2,4-dichloro-3-nitro-benzotrifluorideAKOS025294853
Show more names
4-Dichloro-3-nitrobenzotrifluoride2,4-Dichloro-3-nitrobenzotrifluoride98%2,4-DICHLORO-3-NITROBENZOTRIFLUORIDE, 98% MIN.2,4-Dichloro-3-nitrobenzotrifluoride [CAS:203915-49-5] 1000mg/l in Dichloromethane
CS-03580271,3-Dichloro-2-Nitro-4-(Trifluoromethyl)-Benzene2,4-Dichloro-3-nitrobenzotrifluoride Solution, 1000 mg/L, 1ml
Database identifiers
- CAS
203915-49-5- PubChem CID
- 2736841
- DTXSID
DTXSID20371643
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 45.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 0
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 256
Physicochemical properties
- Boiling point
- 267.5 · 267.5±35.0 °C(Predicted)
- Density
- 1.638 · 1.638±0.06 g/cm3(Predicted)
- form
- crystals
- color
- Colourless to white
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302+H312+H332-H315-H319-H335
- Precautionary statements
- 271 · P271-P260-P280
- Hazard Codes
- Xi
- Risk Statements
- 20 · 20/21/22-36/37/38
- Safety Statements
- 26 · 26-36/37/39
- Hazard Note
- Irritant
- HazardClass
- IRRITANT, IRRITANT-HARMFUL
- HS Code
- 2904990090 · 2904990090
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- hs_code
- 2904990090
- risk_code
- 20/21/22-36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- hazard_note
- Irritant
- safety_code
- 26-36/37/39
- hazard_class
- IRRITANT, IRRITANT-HARMFUL
- Hazard statements
- H302+H312+H332-H315-H319-H335
- Precautionary statements
- P271-P260-P280
Chemistry & industry
Applications
Uses2,4-Dichloro-3-Nitrobenzotrifluoride is a useful reagent in the preparation of aryl ethers as HIF-2α inhibitors used in the treatment of cancers.
Upstream & downstream products
Downstream products
Suppliers8 total
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [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]
Clearsynth Labs Limited+91-22-26355700 · [email protected]
HANGZHOU LEAP CHEM CO., LTD.+86-571-87711850 +86-15355479329 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 13913916777 · [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]
Related reactions
1 records
Compound notes
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