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N- (Cyclohexylmethyl) -2- (2,4-dichlorophenoxy) acetamide

CAT: 0127-OR1072930-01Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0127-OR1072930-01Size:100 mg
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CAS Number
569313-77-5
MDL Number
MFCD04671600
Purity
95%
Smiles
O=C(NCC1CCCCC1)COC2=CC=C(Cl)C=C2Cl

Chemical Information

N-(cyclohexylmethyl)-2-(2,4-dichlorophenoxy)acetamide
CAS Number569313-77-5
PubChem CID2500767
IUPAC NameN-(cyclohexylmethyl)-2-(2,4-dichlorophenoxy)acetamide
Molecular FormulaC15H19Cl2NO2
Molecular Weight316.2
XLogP4.9
Topological Polar Surface Area38.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count5
Heavy Atom Count20
Formal Charge0
Complexity308
SMILES
C1CCC(CC1)CNC(=O)COC2=C(C=C(C=C2)Cl)Cl
InChI
InChI=1S/C15H19Cl2NO2/c16-12-6-7-14(13(17)8-12)20-10-15(19)18-9-11-4-2-1-3-5-11/h6-8,11H,1-5,9-10H2,(H,18,19)
InChIKey
ORLRIVVUGJSCCY-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of N-(cyclohexylmethyl)-2-(2,4-dichlorophenoxy)acetamide
CAS: 569313-77-5
CID: 2500767
Formula: C15H19Cl2NO2
MW: 316.2
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight316.2
XLogP34.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count5
Exact Mass315.0792842
Monoisotopic Mass315.0792842
Topological Polar Surface Area38.3 Ų
Heavy Atom Count20
Formal Charge0
Complexity308
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes