Basic information
- CAS
124743-30-2- Standard SMILES
Nc1nc(=O)n([C@H]2C=C[C@@H](CO)O2)cc1Cl- InChIKey
KOERXKFNWWUHEL-CAHLUQPWSA-N- Molecular formula
- C9H10ClN3O3
- Average molar mass
- 243.65 g/mol
- Monoisotopic mass
- 243.0410689
Overview
structure given in first source
Names & identifiers
- Preferred name
- 2',3'-Didehydro-2',3'-dideoxy-5-chlorocytidine
- IUPAC
- 4-amino-5-chloro-1-[(2R,5S)-5-(hydroxymethyl)-2,5-dihydrofuran-2-yl]pyrimidin-2-one
- English name
- 2',3'-didehydro-2',3'-dideoxy-5-chlorocytidine
- Molecular formula
- C9H10ClN3O3
- Molecular weight
- 243.65
Names & synonyms
124743-30-2D4CC2',3'-Didehydro-2',3'-dideoxy-5-chlorocytidineDTXSID60154472RefChem:80027DTXCID5076963d4ClCyd4-amino-5-chloro-1-[(2r,5s)-5-(hydroxymethyl)-2,5-dihydrofuran-2-yl]pyrimidin-2(1h)-oneD4ClC4-amino-5-chloro-1-[(2R,5S)-5-(hydroxymethyl)-2,5-dihydrofuran-2-yl]pyrimidin-2-oneCHEMBL2369006SCHEMBL30667453
Show more names
Cytidine, 5-chloro-2',3'-didehydro-2',3'-dideoxy-
5-Chloro-2',3'-didehydro-2',3'-dideoxycytidineCytidine, 5-chloro-2',3'-didehydro-2',3'-dideoxy
Database identifiers
- CAS
124743-30-2- PubChem CID
- 72217
- DTXSID
DTXSID60154472- ChEMBL
CHEMBL2369006- Nikkaji
- J322.520H
Properties
Computed structural properties
- XLogP
- -0.7
- Topological polar surface area
- 88.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 405
Chemistry & industry
Suppliers1 total
CHEMICAL LAND21[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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