Didecyl (4-methyl-1,3-phenylene)biscarbamate
Basic information
- CAS
7504-97-4- Standard SMILES
CCCCCCCCCCOC(=O)Nc1ccc(C)c(NC(=O)OCCCCCCCCCC)c1- InChIKey
LMSIVMAYXWIHDZ-UHFFFAOYSA-N- Molecular formula
- C29H50N2O4
- Average molar mass
- 490.7 g/mol
- Monoisotopic mass
- 490.37705808
Names & identifiers
- Preferred name
- Didecyl (4-methyl-1,3-phenylene)biscarbamate
- IUPAC
- decyl N-[3-(decoxycarbonylamino)-4-methylphenyl]carbamate
Names & synonyms
7504-97-4Didecyl (4-methyl-1,3-phenylene)biscarbamateNSC404831SCHEMBL1955495DTXSID90323775STK672133AKOS001707912NSC-404831didecyl (4-methylbenzene-1,3-diyl)biscarbamate
Database identifiers
- CAS
7504-97-4- PubChem CID
- 346565
- DTXSID
DTXSID90323775
Properties
Computed structural properties
- XLogP
- 10.4
- Topological polar surface area
- 76.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 22
- Heavy atoms
- 35
- Formal charge
- 0
- Complexity
- 529
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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