AC1Lddvh
Basic information
- CAS
17749-63-2- Standard SMILES
CC1(C)C2SC3CC(S2)SC1S3- InChIKey
OLIBXUSGVVLUCZ-UHFFFAOYSA-N- Molecular formula
- C8H12S4
- Average molar mass
- 236.5 g/mol
- Monoisotopic mass
- 235.98218508
Names & identifiers
- Preferred name
- AC1Lddvh
- IUPAC
- 9,9-dimethyl-2,4,6,8-tetrathiatricyclo[3.3.1.13,7]decane
- English name
- 9,9-Dimethyl-2,4,6,8-tetrathiaadamantane
- Molecular weight
- 0
Names & synonyms
AC1LDDVH17749-63-2DTXSID30346968RefChem:313910DTXCID402980409,9-Dimethyl-2,4,6,8-tetrathiaadamantane2,4,6,8-Tetrathiaadamantane, 9,9-dimethyl-OLIBXUSGVVLUCZ-UHFFFAOYSA-N9,9-dimethyl-2,4,6,8-tetrathiatricyclo[3.3.1.13,7]decane9,9-Dimethyl-2,4,6,8-tetrathiatricyclo[3.3.1.1~3,7~]decane
Database identifiers
- CAS
17749-63-2- PubChem CID
- 616759
- DTXSID
DTXSID30346968- Nikkaji
- J144.141H
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 101 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 0
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 183
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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