Thiomorpholine, 4-(2-chloroethyl)-
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Basic information
- CAS
63906-73-0- Standard SMILES
ClCCN1CCSCC1- InChIKey
FZAWPBDFRQGFGZ-UHFFFAOYSA-N- Molecular formula
- C6H12ClNS
- Average molar mass
- 165.69 g/mol
- Monoisotopic mass
- 165.0378983
Names & identifiers
- Preferred name
- Thiomorpholine, 4-(2-chloroethyl)-
- IUPAC
- 4-(2-chloroethyl)thiomorpholine
Names & synonyms
4-(2-Chloroethyl)thiomorpholine63906-73-0Thiomorpholine, 4-(2-chloroethyl)-TL 326N-(beta-Chloroethylthiomorpholine)Thiamorpholine, 4-(2-chloroethyl)-BRN 0104428DTXSID90213586NSC 55880RefChem:189566DTXCID20136077MLS002667783
Show more names
SCHEMBL5692350N-(2-chloroethyl)thiomorpholineCHEMBL1903383FZAWPBDFRQGFGZ-UHFFFAOYSA-NHMS3079D12NSC55880NSC-55880AKOS010539669
Database identifiers
- CAS
63906-73-0- PubChem CID
- 96140
- DTXSID
DTXSID90213586- ChEMBL
CHEMBL1903383
Properties
Computed structural propertiesFilling in
- XLogP
- 1.3
- Topological polar surface area
- 28.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 73
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Related reactions
6 records
Compound notes
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