Basic information
- CAS
57876-69-4- Standard SMILES
Cc1cc2ccccc2nc1Cl- InChIKey
UMYPPRQNLXTIEQ-UHFFFAOYSA-N- Molecular formula
- C10H8ClN
- Average molar mass
- 177.63 g/mol
- Monoisotopic mass
- 177.03452694
Names & identifiers
- Preferred name
- 2-Chloro-3-methylquinoline
- IUPAC
- 2-chloro-3-methylquinoline
- English name
- 2-Chloro-3-methylquinoline
- Molecular formula
- C10H8ClN
- Molecular weight
- 177.63
Names & synonyms
2-chloro-3-methylquinolineDTXSID10320761RefChem:468729DTXCID30271882676-560-057876-69-42-Chloro-3-methyl-quinolineMFCD00100265Quinoline, 2-chloro-3-methyl-methyl 2-chloroquinolineNSC3640263-methyl-2-chloroquinoline
Show more names
AKOS BC-0850AKOS BBS-000045522-Cloro-3-methyl-quinoline2-Chloro-3-methylquinoline,97%2-CHLORO-3-METHYLQUINOLINE 97%6-Hydroxyquinoline2-Chloro-3-methylquinoline
2-Chloro-3-methyl quinolineSCHEMBL862325DTXSID103202-chloranyl-3-methyl-quinolineSCHEMBL6975913SCHEMBL15516686UMYPPRQNLXTIEQ-UHFFFAOYSA-NSBB041011
Database identifiers
- CAS
57876-69-4- PubChem CID
- 339082
- DTXSID
DTXSID10320761- EC Number
- 676-560-0
- Nikkaji
- J433.648H
Properties
Computed structural properties
- XLogP
- 3.5
- 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
- 160
Physicochemical properties
- Melting point
- 83 · 83-84 °C
- Boiling point
- 292.84 °C · 292.84°C (rough estimate)
- Density
- 1.181 · 1.1810 (rough estimate)
- refractive index
- 1.6 · 1.6000 (estimate)
- storage temp.
- 2 · under inert gas (nitrogen or Argon) at 2-8°C
- form
- Crystalline Needles or Crystals
- pka
- 0.5 · 0.50±0.50(Predicted)
- color
- White to beige
- Water Solubility
- Insoluble in water.
- CAS DataBase Reference
- 57876 · 57876-69-4(CAS DataBase Reference)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 280 g-P305+P351+P338 · P280g-P305+P351+P338
- Hazard Codes
- Xn
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
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 5 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Safety data
- hs_code
- 29334900
- risk_code
- 22-37/38-41
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xn
- safety_code
- 24/25-39-26
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P280g-P305+P351+P338
Chemistry & industry
Applications
Uses2-Chloro-3-methylquinoline is used as organic chemical synthesis intermediate.
Upstream & downstream products
Downstream products
Suppliers100 total
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]
Hebei Zhuanglai Chemical Trading Co Ltd+86-16264648883 · [email protected]
广州纳珑化工有限公司13192879270; 13192879270 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
Sichuan Biosynce Pharmatech Co., Ltd.[email protected]
宁波季诺化学品有限公司0574-87314919 057487319282 · [email protected]
Baoji Guokang Healthchem co.,ltd+8615604608665 15604608665 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
Related reactions
17 records
Compound notes
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