Basic information
- Standard SMILES
C(=NCCN1CCOCC1)=NC1CCCCC1.COS(=O)(=O)c1ccc(C)cc1- InChIKey
HQXKKQDTQDYERH-UHFFFAOYSA-N- Molecular formula
- C21H33N3O4S
- Average molar mass
- 423.6 g/mol
Names & identifiers
- Preferred name
- N-cyclohexyl-N'-(2-morpholinoethyl)-carbodiimide methyl-p-toluenesulfonate
- IUPAC
- N'-cyclohexyl-N-(2-morpholin-4-ylethyl)methanediimine;methyl 4-methylbenzenesulfonate
Names & synonyms
SCHEMBL9194077HQXKKQDTQDYERH-UHFFFAOYSA-NN-cyclohexyl-N'-(2-morpholinoethyl)-carbodiimide methyl-p-toluenesulfonate
Database identifiers
- PubChem CID
- 9954069
Properties
Computed structural properties
- Topological polar surface area
- 88.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 6
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 481
Related reactions
6 records
Compound notes
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