Basic information
- CAS
74037-78-8- Standard SMILES
CC(CC(=S)N1CCOCC1)CC(C)(C)C- InChIKey
PHTIKHPLGOWBCS-UHFFFAOYSA-N- Molecular formula
- C13H25NOS
- Average molar mass
- 243.41 g/mol
- Monoisotopic mass
- 243.16568559
Names & identifiers
- Preferred name
- 3,5,5-Trimethyl-1-(4-morpholinyl)-1-hexanethione
- IUPAC
- 3,5,5-trimethyl-1-morpholin-4-ylhexane-1-thione
- English name
- 4-(3,5,5-Trimethyl-1-thioxohexyl)morpholine
- Molecular weight
- 0
Names & synonyms
NSC-83169Morpholine, 4-(3,5,5-trimethyl-1-thioxohexyl)-7D972L56CA3,5,5-Trimethyl-1-(4-morpholinyl)-1-hexanethioneRefChem:106585074037-78-84-(3,5,5-Trimethylthiohexanoyl)morpholineNSC83169NSC 83169NCIOpen2_004580Morpholine, 4-(3,5,5-trimethyl-1-thiohexanoyl)-4-(3,5-Trimethylthiohexanoyl)morpholine
Show more names
4-(3,5,5-Trimethyl-1-thioxohexyl)morpholine
Morpholine,5,5-trimethyl-1-thioxohexyl)-Morpholine,5,5-trimethyl-1-thiohexanoyl)-WLN: T6N DOTJ AYUS&1Y1&1X1&1&11-Hexanethione, 3,5,5-trimethyl-1-(4-morpholinyl)-
Database identifiers
- CAS
74037-78-8- PubChem CID
- 98150
- UNII
- 7D972L56CA
- Nikkaji
- J75.127H
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 44.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 229
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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