2-(Chloromethyl)-5-(thiophen-2-yl)-1,3-oxazole
Basic information
- CAS
70996-67-7- Standard SMILES
ClCc1ncc(-c2cccs2)o1- InChIKey
FQMXKWAXICHJLN-UHFFFAOYSA-N- Molecular formula
- C8H6ClNOS
- Average molar mass
- 199.66 g/mol
- Monoisotopic mass
- 198.9858627
Names & identifiers
- Preferred name
- 2-(Chloromethyl)-5-(thiophen-2-yl)-1,3-oxazole
- IUPAC
- 2-(chloromethyl)-5-thiophen-2-yl-1,3-oxazole
Names & synonyms
2-(chloromethyl)-5-(thiophen-2-yl)-1,3-oxazole70996-67-72-(chloromethyl)-5-thiophen-2-yl-1,3-oxazoleSCHEMBL5763248FQMXKWAXICHJLN-UHFFFAOYSA-NDTXSID1012878382-chloromethyl-5-(2-thienyl)oxazoleAKOS0053625132-(Chloromethyl)-5-(2-thienyl)oxazoleEN300-73422F8889-5710
Database identifiers
- CAS
70996-67-7- PubChem CID
- 22009705
- DTXSID
DTXSID101287838
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 54.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 158
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
1 records
Compound notes
Loading…