Basic information
- CAS
109246-29-9- Standard SMILES
O=C(Nc1cccc2ccccc12)NC1CCCCC1- InChIKey
TUVHQVHJITVXAV-UHFFFAOYSA-N- Molecular formula
- C17H20N2O
- Average molar mass
- 268.35 g/mol
- Monoisotopic mass
- 268.15756327
Overview
See also: 1-Cyclohexyl-3-(1-naphthyl)urea (annotation moved to).
Names & identifiers
- Preferred name
- 1-Cyclohexyl-3-naphthalen-1-ylurea
- IUPAC
- 1-cyclohexyl-3-naphthalen-1-ylurea
- English name
- N-cyclohexyl-N'-(1-naphthyl)urea
- Molecular formula
- C17H20N2O
- Molecular weight
- 268.35
Names & synonyms
1-cyclohexyl-3-naphthalen-1-ylurea109246-29-91-cyclohexyl-3-(naphthalen-1-yl)ureaN-cyclohexyl-N'-(1-naphthyl)urea1-Cyclohexyl-3-naphthalen-1-yl-ureaMLS001211787CHEMBL1713120SCHEMBL10089305DTXSID10356742BDBM129292HMS2841E13STK832953
Show more names
1-CYCLOHEXYL-3-(1-NAPHTHYL)UREAUrea, N-cyclohexyl-N'-1-naphthalenyl-
AKOS000497822(cyclohexylamino)-N-naphthylcarboxamideEBC-610449N-Cyclohexyl-N'-(naphthalen-1-yl)ureaSMR000505124ST45045313US8815951, 59AN-329/40180130
Database identifiers
- CAS
109246-29-9- PubChem CID
- 830951
- DTXSID
DTXSID10356742- ChEMBL
CHEMBL1713120
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 41.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 325
Experimental & physicochemical properties
Solubility<0.3 [ug/mL] (The mean of the results at pH 7.4)
Physicochemical properties
- Melting point
- 237 · 237.0-238.0 °C
- Boiling point
- 426.9 · 426.9±18.0 °C(Predicted)
- Density
- 1.15 · 1.15±0.1 g/cm3(Predicted)
- pka
- 13 · 13+-.0.20(Predicted)
- Symbol(GHS)
- 9 · GHS09
- Signal word
- Warning
- Hazard statements
- 410 · H410
- Precautionary statements
- 273 · P273-P391-P501
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)
- GHS09
- Hazard statements
- H410
- Precautionary statements
- P273-P391-P501
Chemistry & industry
Suppliers1 total
济南思考化学有限公司0531-0000 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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