Basic information
- CAS
73664-67-2- Standard SMILES
C=CCN(C(=O)c1cc(OC)c(OC)c(OC)c1)C1CCCCC1- InChIKey
GXTBHFVSSYGNSY-UHFFFAOYSA-N- Molecular formula
- C19H27NO4
- Average molar mass
- 333.4 g/mol
- Monoisotopic mass
- 333.19400834
Names & identifiers
- Preferred name
- Benzamide, N-allyl-N-cyclohexyl-3,4,5-trimethoxy-
- IUPAC
- N-cyclohexyl-3,4,5-trimethoxy-N-prop-2-enylbenzamide
- English name
- N-Allyl-N-cyclohexyl-3,4,5-trimethoxybenzamide
- Molecular formula
- C19H27NO4
- Molecular weight
- 333.42
Names & synonyms
N-Allyl-N-cyclohexyl-3,4,5-trimethoxybenzamideBRN 2668042BENZAMIDE, N-ALLYL-N-CYCLOHEXYL-3,4,5-TRIMETHOXY-73664-67-2DTXSID50223904RefChem:322462DTXCID40146395N-cyclohexyl-3,4,5-trimethoxy-N-(prop-2-en-1-yl)benzamideBenzamide, N-cyclohexyl-3,4,5-trimethoxy-N-2-propen-1-yl-
Database identifiers
- CAS
73664-67-2- PubChem CID
- 52080
- DTXSID
DTXSID50223904- Nikkaji
- J148.967D
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 48 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 394
Physicochemical properties
- Boiling point
- 492.6 · 492.6±45.0 °C(Predicted)
- Density
- 1.1 · 1.10±0.1 g/cm3(Predicted)
- pka
- -1.46 · -1.46±0.20(Predicted)
- InChI
- 1S/C19H27NO4/c1-5-11-20(15-9-7-6-8-10-15)19(21)14-12-16(22-2)18(24-4)17(13-14)23-3/h5,12-13,15H,1,6-11H2,2-4H3
- SMILES
- O=C(C(C=C1OC)=CC(OC)=C1OC)N(C2CCCCC2)CC=C
Chemistry & industry
Suppliers1 total
西格玛奥德里奇（上海）贸易有限公司21-20338288 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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