Basic information
- CAS
59288-10-7- Standard SMILES
CNc1c(N)c(=O)oc2ccccc12- InChIKey
VUGQMTSDCGZIHF-UHFFFAOYSA-N- Molecular formula
- C10H10N2O2
- Average molar mass
- 190.2 g/mol
- Monoisotopic mass
- 190.07422757
Names & identifiers
- Preferred name
- Coumarin, 3-amino-4-methylamino-
- IUPAC
- 3-amino-4-(methylamino)chromen-2-one
- English name
- 3-amino-4-(methylamino)-2H-chromen-2-one
- Molecular formula
- C10H10N2O2
- Molecular weight
- 190.1986
Names & synonyms
59288-10-73-amino-4-(methylamino)-2H-chromen-2-one3-amino-4-(methylamino)chromen-2-oneCOUMARIN, 3-AMINO-4-METHYLAMINO-3-AMINO-4-METHYLAMINOCOUMARIN3-Amino-4-(methylamino)-2H-1-benzopyran-2-one4-Methylamino-3-aminocoumarinBRN 1640721Oprea1_597478Oprea1_758034MLS000693658CHEMBL3199729
Show more names
SCHEMBL14399066DTXSID20208006HMS2633F18HMS3363E02AKOS000482954NCGC00245227-01SMR000285414ST50244933
Database identifiers
- CAS
59288-10-7- PubChem CID
- 42997
- DTXSID
DTXSID20208006- ChEMBL
CHEMBL3199729- Nikkaji
- J67.658F
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 64.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 286
Chemistry & industry
Suppliers1 total
SPECS[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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