6-chloro-2-oxo-4-propyl-2H-chromen-7-yl [(tert-butoxycarbonyl)amino](phenyl)acetate
Basic information
- CAS
4887-76-7- Standard SMILES
CCCc1cc(=O)oc2cc(OC(=O)C(NC(=O)OC(C)(C)C)c3ccccc3)c(Cl)cc12- InChIKey
AXERJOLHOIUNES-UHFFFAOYSA-N- Molecular formula
- C25H26ClNO6
- Average molar mass
- 471.9 g/mol
- Monoisotopic mass
- 471.1448652
Names & identifiers
- Preferred name
- 6-chloro-2-oxo-4-propyl-2H-chromen-7-yl [(tert-butoxycarbonyl)amino](phenyl)acetate
- IUPAC
- (6-chloro-2-oxo-4-propylchromen-7-yl) 2-[(2-methylpropan-2-yl)oxycarbonylamino]-2-phenylacetate
Names & synonyms
4887-76-7AC1NQHRHDTXSID10411103STK595984AKOS0055174506-chloro-2-oxo-4-propyl-2H-chromen-7-yl [(tert-butoxycarbonyl)amino](phenyl)acetate6-Chloro-2-oxo-4-propyl-2H-1-benzopyran-7-yl [(tert-butoxycarbonyl)amino](phenyl)acetate6-chloro-2-oxo-4-propyl-2H-chromen-7-yl 2-((tert-butoxycarbonyl)amino)-2-phenylacetate
Database identifiers
- CAS
4887-76-7- PubChem CID
- 5221871
- DTXSID
DTXSID10411103
Properties
Computed structural properties
- XLogP
- 5.6
- Topological polar surface area
- 90.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 9
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 754
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…