Basic information
- CAS
840488-85-9- Standard SMILES
O=C(NCCC1CC1)c1ccc(Cl)nn1- InChIKey
ZNOCYNRWXAYNOU-UHFFFAOYSA-N- Molecular formula
- C10H12ClN3O
- Average molar mass
- 225.67 g/mol
- Monoisotopic mass
- 225.06688968
Names & identifiers
- Preferred name
- 6-Chloro-N-(2-cyclopropylethyl)pyridazine-3-carboxamide
- IUPAC
- 6-chloro-N-(2-cyclopropylethyl)pyridazine-3-carboxamide
- English name
- 6-chloro-N-(2-cyclopropylethyl)pyridazine-3-carboxaMide
- Molecular formula
- C10H12ClN3O
- Molecular weight
- 225.67
Names & synonyms
840488-85-96-chloro-N-(2-cyclopropylethyl)pyridazine-3-carboxamideDTXSID70734901RefChem:308088DTXCID10685645800-824-8MFCD212553806-Chloro-N-(2-cyclopropylethyl)-pyridazine-3-carboxamide3-Pyridazinecarboxamide, 6-chloro-N-(2-cyclopropylethyl)-SCHEMBL937257ZNOCYNRWXAYNOU-UHFFFAOYSA-N6-CHLOROPYRIDAZINE-3-CARBOXYLIC ACID (2-CYCLOPROPYL-ETHYL)AMIDE
Show more names
AKOS014899767DH-0024DA-02491CS-0330951N-(2-Cyclopropylethyl)-6-chloropyridazine-3-carboxamide6-chloropyridazine-3-carboxylic acid (2-cyclopropylethyl)-amide6-CHLOROPYRIDAZINE-3-CARBOXYLIC Acid (2-CYCLOPROPYLETHYL)AMIDE
Database identifiers
- CAS
840488-85-9- PubChem CID
- 65561565
- DTXSID
DTXSID70734901- EC Number
- 800-824-8
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 54.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 233
Physicochemical properties
- Boiling point
- 466.6 · 466.6±30.0 °C(Predicted)
- Density
- 1.297 · 1.297±0.06 g/cm3(Predicted)
- pka
- 12.63 · 12.63±0.46(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 332 · H332-H312-H315-H302-H335-H319
- Precautionary statements
- 280 · P280-P302+P352-P312-P322-P363-P501-P264-P280-P302+P352-P321-P332+P313-P362-P264-P270-P301+P312-P330-P501-P261-P271-P304+P340-P312-P264-P280-P305+P351+P338-P337+P313P
- HS Code
- 2933399990 · 2933399990
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, P317, 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
- 2933399990
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H332-H312-H315-H302-H335-H319
- Precautionary statements
- P280-P302+P352-P312-P322-P363-P501-P264-P280-P302+P352-P321-P332+P313-P362-P264-P270-P301+P312-P330-P501-P261-P271-P304+P340-P312-P264-P280-P305+P351+P338-P337+P313P
Chemistry & industry
Suppliers1 total
陕西缔都新材料有限公司81124267 17392282731 · [email protected]
Related reactions
93 records
Compound notes
Loading…