Basic information
- CAS
703-61-7- Standard SMILES
Clc1cc(Cl)c2ccccc2n1- InChIKey
QNBJYUUUYZVIJP-UHFFFAOYSA-N- Molecular formula
- C9H5Cl2N
- Average molar mass
- 198.05 g/mol
- Monoisotopic mass
- 196.97990452
Names & identifiers
- Preferred name
- 2,4-Dichloroquinoline
- IUPAC
- 2,4-dichloroquinoline
- English name
- 2,4-Dichloroquinoline
- Molecular formula
- C9H5Cl2N
- Molecular weight
- 198.05
Names & synonyms
2,4-Dichloroquinoline703-61-7Quinoline, 2,4-dichloro-DTXSID60345843RefChem:82399DTXCID50296916640-568-2QNBJYUUUYZVIJP-UHFFFAOYSA-NMFCD000239392,4-dichloro-quinoline2,4-Dichloro quinolineCS-D0244
Show more names
AURORA KA-3862IFLAB-BB F1706-0118Quinoline,2,4-dichloro-2,4-Dichloroquinoline>2,4-Dichloroquinoline 98%2-4-Dichloro-1-azanaphthalene2,4-dichloroquinoline(SALTDATA: FREE)
AR3674AKOS005264636SY047605AF-753/002950022,4-Dichlorochinoline; 2,4-Dichloroquinoline ;2,4-bis(chloranyl)quinolineBCP20135AM804253
Database identifiers
- CAS
703-61-7- PubChem CID
- 607503
- DTXSID
DTXSID60345843- EC Number
- 640-568-2
- Nikkaji
- J79.917C
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 12.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 163
Physicochemical properties
- Melting point
- 52 · 52-54
- Boiling point
- 282 °C · 282°C(lit.)
- Density
- 1.4178 · 1.4178 (rough estimate)
- refractive index
- 1.661 · 1.6610 (estimate)
- storage temp.
- Keep in dark place,Sealed in dry,Room Temperature
- solubility
- Chloroform, Methanol
- form
- Solid
- pka
- -1.1 · -1.10±0.50(Predicted)
- color
- White
- λmax
- 305 nm · 305nm(MeOH)(lit.)
- InChI
- InChI=1S/C9H5Cl2N/c10-7-5-9(11)12-8-4-2-1-3-6(7)8/h1-5H
- InChIKey
- QNBJYUUUYZVIJP-UHFFFAOYSA-N
- SMILES
- N1C2C(=CC=CC=2)C(Cl)=CC=1Cl
- CAS DataBase Reference
- 703 · 703-61-7(CAS DataBase Reference)
- Symbol(GHS)
- 5 · GHS05,GHS06,GHS07
- Signal word
- Danger
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
Danger
H301 (95.1%): Toxic if swallowed [Danger Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P316, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 41 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAcute Tox. 3 (95.1%)
Safety data
- wgk
- 3
- ridadr
- 2811
- hs_code
- 2933491090
- risk_code
- 36/37/38-41-37/38-25
- Signal word
- Danger
- Symbol(GHS)
- GHS05,GHS06,GHS07
- hazard_code
- Xi,T
- hazard_note
- Irritant
- safety_code
- 26-36-45-39
- hazard_class
- 6.1
- packing_group
- Ⅲ
- Hazard statements
- H301-H315-H318-H335-H319
- Precautionary statements
- P261-P280-P301+P310-P305+P351+P338-P264-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313
Chemistry & industry
Applications
Uses2,4-Dichloroquinoline is used in the synthesis of tRNA synthetase inhibitors with antibacterial activity against gram-positive bacteria. Also used in the preparation of arylquinolines displaying anthelmintic properties.
Upstream & downstream products
Downstream products
Suppliers100 total
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
郑州阿尔法化工有限公司+86-18530059196 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
BAYNOE CHEM CO.,LTD+86-21-34783353 +8615000719740 · [email protected]
温州共赢化学有限公司+86-0086-577-64498589 +86-15355981851 · [email protected]
环生美森医药技术（山东）有限公司0531-88762217 18301471076 · [email protected]
宁波季诺化学品有限公司0574-87314919 057487319282 · [email protected]
Hunan Jibang Biological Technology Co., LTD13776644403 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.
Related reactions
33 records
Compound notes
Loading…