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N-Benzyl-2-naphthamide

CAT: 0127-OR1063125-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0127-OR1063125-01Size:25 mg
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CAS Number
149358-58-7
MDL Number
MFCD00540919
Purity
98%
Smiles
O=C(C1=CC=C2C=CC=CC2=C1)NCC3=CC=CC=C3

Chemical Information

N-benzyl-2-naphthamide
CAS Number149358-58-7
PubChem CID778918
IUPAC NameN-benzylnaphthalene-2-carboxamide
Molecular FormulaC18H15NO
Molecular Weight261.3
XLogP4.5
Topological Polar Surface Area29.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count3
Heavy Atom Count20
Formal Charge0
Complexity321
SMILES
C1=CC=C(C=C1)CNC(=O)C2=CC3=CC=CC=C3C=C2
InChI
InChI=1S/C18H15NO/c20-18(19-13-14-6-2-1-3-7-14)17-11-10-15-8-4-5-9-16(15)12-17/h1-12H,13H2,(H,19,20)
InChIKey
DKPOPWSPIGABJL-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of N-benzyl-2-naphthamide
CAS: 149358-58-7
CID: 778918
Formula: C18H15NO
MW: 261.3
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight261.3
XLogP34.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count3
Exact Mass261.115364102
Monoisotopic Mass261.115364102
Topological Polar Surface Area29.1 Ų
Heavy Atom Count20
Formal Charge0
Complexity321
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

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Alternative Products

CatalogName
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