Basic information
- CAS
3818-64-2- Standard SMILES
COc1ccc2c(=O)c(C)c(C)oc2c1CN1CCOCC1- InChIKey
GJTMNUHTYIJXTJ-UHFFFAOYSA-N- Molecular formula
- C17H21NO4
- Average molar mass
- 303.35 g/mol
- Monoisotopic mass
- 303.14705815
Names & identifiers
- Preferred name
- 2,3-Dimethyl-7-methoxy-8-(morpholinomethyl)chromone
- IUPAC
- 7-methoxy-2,3-dimethyl-8-(morpholin-4-ylmethyl)chromen-4-one
- English name
- 7-methoxy-2,3-dimethyl-8-(morpholinomethyl)-4-benzopyrone
- Molecular formula
- C17H21NO4
- Molecular weight
- 303.35294
Names & synonyms
3818-64-22,3-Dimethyl-7-methoxy-8-(morpholinomethyl)chromoneYM1JWR09WWEINECS 223-309-4NSC 169870BRN 1084330UNII-YM1JWR09WWCHROMONE, 7-METHOXY-2,3-DIMETHYL-8-(MORPHOLINOMETHYL)-NSC-1698704H-1-Benzopyran-4-one, 7-methoxy-2,3-dimethyl-8-(4-morpholinylmethyl)-DTXSID40191562REC-7-0105
Show more names
REC-7-01657-Methoxy-2,3-dimethyl-8-(morpholinomethyl)chromone
7-METHOXY-2,3-DIMETHYL-8-(4-MORPHOLINYLMETHYL)-4H-1-BENZOPYRAN-4-ONERefChem:81845DTXCID801140534H-1-Benzopyran-4-one, 7-methoxy-2,3-dimethyl-8-(4-morpholinylmethyl)-(9CI)223-309-4REC 7-01057-Methoxy-2,3-dimethyl-8-(morpholinomethyl)-4-benzopyrone7-methoxy-2,3-dimethyl-8-[(morpholin-4-yl)methyl]-4H-chromen-4-one
Database identifiers
- CAS
3818-64-2- PubChem CID
- 19669
- DTXSID
DTXSID40191562- UNII
- YM1JWR09WW
- EC Number
- 223-309-4
- Nikkaji
- J72.686I
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 48 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 456
Experimental & physicochemical properties
Endocrine DisruptorsPotential endocrine disrupting compound
Physicochemical properties
- FDA UNII
- 1 JWR09WW · YM1JWR09WW
Chemistry & industry
Suppliers1 total
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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