CID 44665297
PubChem CID
44665297
Structure
Molecular Formula
Status
Non-live
Molecular Weight
301.81 g/mol
Dates
- Create:2010-03-11
Chemical Structure Depiction
3-(2,3-dihydro-1,4-benzodioxin-5-yloxy)-N,N-diethylpropan-1-amine;hydrochloride
InChI=1S/C15H23NO3.ClH/c1-3-16(4-2)9-6-10-17-13-7-5-8-14-15(13)19-12-11-18-14;/h5,7-8H,3-4,6,9-12H2,1-2H3;1H
DRSGUSUJMGTYBO-UHFFFAOYSA-N
CCN(CC)CCCOC1=CC=CC2=C1OCCO2.Cl
C15H24ClNO3
Property Name
Property Value
Reference
Property Name
Molecular Weight
Property Value
301.81 g/mol
Property Name
Hydrogen Bond Donor Count
Property Value
1
Property Name
Hydrogen Bond Acceptor Count
Property Value
4
Property Name
Rotatable Bond Count
Property Value
7
Property Name
Exact Mass
Property Value
301.1444713 g/mol
Property Name
Monoisotopic Mass
Property Value
301.1444713 g/mol
Property Name
Topological Polar Surface Area
Property Value
30.9 A^2
Property Name
Heavy Atom Count
Property Value
20
Property Name
Formal Charge
Property Value
0
Property Name
Complexity
Property Value
246
Property Name
Isotope Atom Count
Property Value
0
Property Name
Defined Atom Stereocenter Count
Property Value
0
Property Name
Undefined Atom Stereocenter Count
Property Value
0
Property Name
Defined Bond Stereocenter Count
Property Value
0
Property Name
Undefined Bond Stereocenter Count
Property Value
0
Property Name
Covalently-Bonded Unit Count
Property Value
2
Property Name
Compound Is Canonicalized
Property Value
Yes
Old substance
CONTENTS