1,3,5-Tris-(p-(dodec-1-yloxycarbonyl)-anilino)-s-triazine

HCID 20152739
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Basic information

Standard SMILES
CCCCCCCCCCCCOC(=O)c1ccc(NN2CN(Nc3ccc(C(=O)OCCCCCCCCCCCC)cc3)CN(Nc3ccc(C(=O)OCCCCCCCCCCCC)cc3)C2)cc1
InChIKey
GHUJWSANOWGERQ-UHFFFAOYSA-N
Molecular formula
C60H96N6O6
Average molar mass
997.4 g/mol
Monoisotopic mass
996.7391348

Names & identifiers

Preferred name
1,3,5-Tris-(p-(dodec-1-yloxycarbonyl)-anilino)-s-triazine
IUPAC
dodecyl 4-[[3,5-bis(4-dodecoxycarbonylanilino)-1,3,5-triazinan-1-yl]amino]benzoate

Names & synonyms

SCHEMBL10664774GHUJWSANOWGERQ-UHFFFAOYSA-N1,3,5-Tris-(p-(dodec-1-yloxycarbonyl)-anilino)-s-triazine

Database identifiers

PubChem CID
20152739

Properties

Computed structural properties

XLogP
22.3
Topological polar surface area
125 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
12
Rotatable bonds
45
Heavy atoms
72

Related reactions

2 records
New reaction record

Linked notes

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