CBMicro_048206
Basic information
- CAS
15088-29-6- Standard SMILES
NC(=O)c1ccc(C(=O)N(C2CCCCC2)C2CCCCC2)cc1- InChIKey
OXJCOJXHCPVIPV-UHFFFAOYSA-N- Molecular formula
- C20H28N2O2
- Average molar mass
- 328.4 g/mol
- Monoisotopic mass
- 328.21507814
Names & identifiers
- Preferred name
- CBMicro_048206
- IUPAC
- 4-N,4-N-dicyclohexylbenzene-1,4-dicarboxamide
- English name
- N,N'-Dicyclohexylterephthalamide
- Molecular formula
- C20H28N2O2
- Molecular weight
- 328.45
Names & synonyms
CBMicro_048206DTXSID90355197RefChem:333598DTXCID603062574-N,4-N-dicyclohexylbenzene-1,4-dicarboxamideCambridge id 5306473Oprea1_529181N'-dicyclohexylterephthalamideSCHEMBL812387N,N-dicyclohexylterephthalamideAKOS032947945BIM-0048086.P001
Show more names
N,N'-DicyclohexylterephthalamideN1,N4-dicyclohexylterephthalamideN,N-Dicyclohexylbenzene-1,4-dicarboxamide1,4-Benzenedicarboxamide, N1,N4-dicyclohexyl-
N~1~,N~1~-Dicyclohexylbenzene-1,4-dicarboxamideSR-01000520103SR-01000520103-1
Database identifiers
- CAS
15088-29-6- PubChem CID
- 793758
- DTXSID
DTXSID90355197
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 63.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 413
Physicochemical properties
- Melting point
- 197 °C · 197 °C
- Boiling point
- 571.4 · 571.4±33.0 °C(Predicted)
- Density
- 1.12 · 1.12±0.1 g/cm3(Predicted)
- pka
- 13.7 · 13.70±0.20(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P280-P301+P312-P302+P352-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P280-P301+P312-P302+P352-P305+P351+P338
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Related reactions
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Compound notes
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