Basic information
- CAS
129798-05-6- Standard SMILES
CCOc1ccc2cc(C=O)c(Cl)nc2c1- InChIKey
IIWVEXSCELRQAP-UHFFFAOYSA-N- Molecular formula
- C12H10ClNO2
- Average molar mass
- 235.66 g/mol
- Monoisotopic mass
- 235.04000624
Names & identifiers
- Preferred name
- 2-Chloro-7-ethoxyquinoline-3-carbaldehyde
- IUPAC
- 2-chloro-7-ethoxyquinoline-3-carbaldehyde
- English name
- 2-Chloro-7-ethoxy-3-quinolinecarbaldehyde
- Molecular formula
- C12H10ClNO2
- Molecular weight
- 235.67
Names & synonyms
2-chloro-7-ethoxyquinoline-3-carbaldehyde129798-05-6DTXSID60354258RefChem:259162DTXCID903053193-Quinolinecarboxaldehyde, 2-chloro-7-ethoxy-2-Chloro-7-ethoxy-quinoline-3-carbaldehydeMFCD009958282-Chloro-7-ethoxyquinoline-3-carboxaldehyde2-chloro-7-ethoxy-3-quinolinecarbaldehydeOprea1_427271Oprea1_761268
Show more names
IFLAB-BB F0010-06022-chloro-7-ethoxy-3-quinolinecarboxaldehyde
SCHEMBL5210416SCHEMBL29878223IIWVEXSCELRQAP-UHFFFAOYSA-NALBB-025566SBB013852STK7270582-Chloro-3-formyl-7-ethoxy-quinolineAKOS000678395
Database identifiers
- CAS
129798-05-6- PubChem CID
- 767416
- DTXSID
DTXSID60354258- EC Number
- 173-281-1
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 39.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 249
Physicochemical properties
- Hazard Codes
- Xi
- HS Code
- 2933499090 · 2933499090
Safety & regulation
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, 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 CategoriesAcute Tox. 4 (100%)
Safety data
- hs_code
- 2933499090
- hazard_code
- Xi
Chemistry & industry
Suppliers8 total
苏州启航生物科技有限公司18151111370 · [email protected]
上海超岚化工科技中心（原上海巢莱）0-2022843681 15618226720 · [email protected]
砌块化学科技（上海）有限公司021-20432219 13918097649 · [email protected]
上海人兮科技有限公司021-67759270 17717059219 · [email protected]
ATK CHEMICAL COMPANY LIMITED+undefined-21-51877795 · [email protected]
深圳聚合生化科技有限公司+86-400-002-6226 · [email protected]
河北药成医药科技有限责任公司19903117580 19903117510 · [email protected]
南京世洲生物科技有限公司025-85563444 15850508050 · [email protected]
Related reactions
1 records
Compound notes
Loading…