Carbamic acid, methyl((octadecyloxy)thio)-, 2,3-dihydro-2,2-dimethyl-7-benzofuranyl ester
Basic information
- CAS
86627-81-8- Standard SMILES
CCCCCCCCCCCCCCCCCCOSN(C)C(=O)Oc1cccc2c1OC(C)(C)C2- InChIKey
NLISLONXYFAEMK-UHFFFAOYSA-N- Molecular formula
- C30H51NO4S
- Average molar mass
- 521.8 g/mol
- Monoisotopic mass
- 521.35388028
Names & identifiers
- Preferred name
- Carbamic acid, methyl((octadecyloxy)thio)-, 2,3-dihydro-2,2-dimethyl-7-benzofuranyl ester
- IUPAC
- (2,2-dimethyl-3H-1-benzofuran-7-yl) N-methyl-N-octadecoxysulfanylcarbamate
Names & synonyms
Carbamic acid, methyl((octadecyloxy)thio)-, 2,3-dihydro-2,2-dimethyl-7-benzofuranyl ester86627-81-8DTXSID202357312,3-Dihydro-2,2-dimethyl-7-benzofuranyl (methyl)(octadecyloxysulfenyl)carbamateRefChem:332500DTXCID50158222SCHEMBL111870672,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methyl[(octadecyloxy)sulfanyl]carbamate
Database identifiers
- CAS
86627-81-8- PubChem CID
- 55529
- DTXSID
DTXSID20235731
Properties
Computed structural properties
- XLogP
- 11.9
- Topological polar surface area
- 73.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 21
- Heavy atoms
- 36
- Formal charge
- 0
- Complexity
- 573
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…