Basic information
- CAS
56287-41-3- Standard SMILES
CCN(CC)CCOCCC1(C)Oc2ccc(Cl)cc2O1- InChIKey
ZMBBYYGTHPAZOF-UHFFFAOYSA-N- Molecular formula
- C16H24ClNO3
- Average molar mass
- 313.82 g/mol
- Monoisotopic mass
- 313.1444713
Names & identifiers
- Preferred name
- 1,3-Benzodioxole, 5-chloro-2-(2-(2-(diethylamino)ethoxy)ethyl)-2-methyl-
- IUPAC
- 2-[2-(5-chloro-2-methyl-1,3-benzodioxol-2-yl)ethoxy]-N,N-diethylethanamine
Names & synonyms
56287-41-3RefChem:10527011,3-Benzodioxole, 5-chloro-2-(2-(2-(diethylamino)ethoxy)ethyl)-2-methyl-LR-5292-Methyl-5-chloro-2-(N,N-diethylaminoethoxyethyl)-1,3-benzodioxoleNSC3097032-(2-(5-Chloro-2-methyl-1,3-benzodioxol-2-yl)ethoxy)-N,N-diethylethanamine5-Chloro-2-(2-(2-(diethylamino)ethoxy)ethyl)-2-methyl-1,3-benzodioxole1,3-BENZODIOXOLE, 5-CHLORO-2-(2-(2-(DIETHYLAMINO)ETHOXY)ETHYL)-2 -METHYL-SCHEMBL11628835NSC 309703NSC-309703
Show more names
DS-0089395-Chloro-2-(2-(2-(diethylamino)ethoxy) ethyl)-2-methyl-1,3-benzodioxole
Database identifiers
- CAS
56287-41-3- PubChem CID
- 41828
- Nikkaji
- J71.472K
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 30.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 8
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 314
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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