Basic information
- CAS
546070-44-4- Standard SMILES
CCCC(=O)Nc1cccnc1Cl- InChIKey
UYVCKWSCSBBXER-UHFFFAOYSA-N- Molecular formula
- C9H11ClN2O
- Average molar mass
- 198.65 g/mol
- Monoisotopic mass
- 198.0559907
Names & identifiers
- Preferred name
- N-(2-chloropyridin-3-yl)butanamide
- IUPAC
- N-(2-chloro-3-pyridinyl)butanamide
- English name
- N-(2-chloro-3-pyridinyl)butanamide
- Molecular formula
- C9H11ClN2O
- Molecular weight
- 198.64944
Names & synonyms
N-(2-chloropyridin-3-yl)butanamide546070-44-4RefChem:825282897-962-4WNSN-(2-chloro-3-pyridinyl)butanamideAKOS003799313G49591EN300-8100327AN-652/42125916Z240654968
Database identifiers
- CAS
546070-44-4- PubChem CID
- 836741
- EC Number
- 897-962-4
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 42 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 175
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 (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%)
Chemistry & industry
Suppliers2 total
南京世洲生物科技有限公司025-025-85560043 17301488900 · [email protected]
南京世洲生物科技有限公司025-85560043 13675144456 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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