Basic information
- CAS
2722-34-1- Standard SMILES
c1ccc(C2=NCCS2)cc1- InChIKey
INYWZIMQKOYAJV-UHFFFAOYSA-N- Molecular formula
- C9H9NS
- Average molar mass
- 163.24 g/mol
- Monoisotopic mass
- 163.04557046
Names & identifiers
- Preferred name
- Thiazole, 4,5-dihydro-2-phenyl-
- IUPAC
- 2-phenyl-4,5-dihydro-1,3-thiazole
Names & synonyms
Thiazole, 4,5-dihydro-2-phenyl-2722-34-14,5-Dihydro-2-phenylthiazole2-phenyl-4,5-dihydro-1,3-thiazoleBRN 0119252Phenyl-2 delta-2 thiazoline [French]Phenyl-2 delta-2 thiazolinephenylthiazolineSCHEMBL533168SCHEMBL11477512-phenyl-4,5-dihydro-thiazoleCHEMBL3323441
Show more names
SCHEMBL11152717SCHEMBL27528394SCHEMBL27814963SCHEMBL27867839DTXSID201816882-phenyl-4,5-dihydro-1,3-thiazolAKOS006372932
Database identifiers
- CAS
2722-34-1- PubChem CID
- 200788
- DTXSID
DTXSID20181688- ChEMBL
CHEMBL3323441- Nikkaji
- J425.756A
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 37.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 159
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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