Basic information
- CAS
22244-18-4- Standard SMILES
CCCNC(=O)C1CNc2ccccc2O1- InChIKey
MNXXJUKTNKKCCX-UHFFFAOYSA-N- Molecular formula
- C12H16N2O2
- Average molar mass
- 220.27 g/mol
- Monoisotopic mass
- 220.12117776
Names & identifiers
- Preferred name
- N-propyl-3,4-dihydro-2H-1,4-benzoxazine-2-carboxamide
- IUPAC
- N-propyl-3,4-dihydro-2H-1,4-benzoxazine-2-carboxamide
- English name
- N-PROPYL-3,4-DIHYDRO-2H-1,4-BENZOXAZINE-2-CARBOXAMIDE
- Molecular formula
- C12H16N2O2
- Molecular weight
- 220.27
Names & synonyms
22244-18-4N-propyl-3,4-dihydro-2H-1,4-benzoxazine-2-carboxamideDTXSID10274917RefChem:831051DTXCID40226368999-727-2N-Propyl-3,4-dihydro-2H-benzo[b][1,4]oxazine-2-carboxamideHMS2171F07MLS000566679CHEMBL1518122SCHEMBL17432607HMS1730O06
Show more names
3,4-Dihydro-N-propyl-2H-1,4-benzoxazine-2-carboxamide2H-1,4-Benzoxazine-2-carboxaMide,3,4-dihydro-N-propyl-3,4-Dihydro-N-propyl-2H-benzo[b][1,4]oxazine-2-carboxamide
HMS3316F12MFCD06373520AKOS000206330AKOS017269865NCGC00246114-01SMR000153591SY144661CS-0223903
Database identifiers
- CAS
22244-18-4- PubChem CID
- 31092
- DTXSID
DTXSID10274917- ChEMBL
CHEMBL1518122- EC Number
- 999-727-2
- Nikkaji
- J678.486K
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 50.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 245
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
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, 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)
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
Suppliers3 total
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
上海研邦医药科技有限公司15618536883 · [email protected]
陕西缔都化学有限公司17691182729 17392216275 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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