Basic information
- CAS
309927-61-5- Standard SMILES
COc1ccc(C(=O)NCC2CCCO2)cc1OC- InChIKey
XENHVEGRCFKEIE-UHFFFAOYSA-N- Molecular formula
- C14H19NO4
- Average molar mass
- 265.3 g/mol
- Monoisotopic mass
- 265.13140809
Names & identifiers
- Preferred name
- 3,4-dimethoxy-N-(oxolan-2-ylmethyl)benzamide
- IUPAC
- 3,4-dimethoxy-N-(oxolan-2-ylmethyl)benzamide
- English name
- 3,4-dimethoxy-N-(tetrahydro-2-furanylmethyl)benzamide
- Molecular formula
- C14H19NO4
- Molecular weight
- 265.30496
Names & synonyms
3,4-dimethoxy-N-(oxolan-2-ylmethyl)benzamide3,4-dimethoxy-N-(tetrahydro-2-furanylmethyl)benzamideOprea1_068440Oprea1_358434MLS000711679CHEMBL2142548HMS2744N10STK003947AKOS000640774AKOS016195523309927-61-5SMR000281446
Show more names
ST042966AK-968/09392060SR-01000435010SR-01000435010-13,4-dimethoxy-N-(tetrahydrofuran-2-ylmethyl)benzamideZ31490580(3,4-dimethoxyphenyl)-N-(oxolan-2-ylmethyl)carboxamide
Database identifiers
- CAS
309927-61-5- PubChem CID
- 2853045
- ChEMBL
CHEMBL2142548- EC Number
- 146-228-5
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 56.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 297
Experimental & physicochemical properties
Solubility35.7 [ug/mL] (The mean of the results at pH 7.4)
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
H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]
P264, P264+P265, P270, P280, P301+P316, P305+P351+P338, P321, P330, P337+P317, 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. 3 (100%)
Chemistry & industry
Suppliers2 total
西格玛奥德里奇（上海）贸易有限公司21-20338288 · [email protected]
SPECS[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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