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1-Amino-2-naphthaldehyde

CAT: 1266-JH917754Size: 1 EachDry Ice: NoHazardous: No
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CAS Number
176853-41-1
Molecular Formula
C11H9NO
Molecular Weight
171.2

Chemical Information

1-Amino-2-naphthalenecarbaldehyde
CAS Number176853-41-1
PubChem CID10997483
IUPAC Name1-aminonaphthalene-2-carbaldehyde
Molecular FormulaC11H9NO
Molecular Weight171.19
XLogP2.5
Topological Polar Surface Area43.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Heavy Atom Count13
Formal Charge0
Complexity193
SMILES
C1=CC=C2C(=C1)C=CC(=C2N)C=O
InChI
InChI=1S/C11H9NO/c12-11-9(7-13)6-5-8-3-1-2-4-10(8)11/h1-7H,12H2
InChIKey
NZGWBDGBNINXJY-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1-Amino-2-naphthalenecarbaldehyde
CAS: 176853-41-1
CID: 10997483
Formula: C11H9NO
MW: 171.19
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight171.19
XLogP32.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Exact Mass171.068413911
Monoisotopic Mass171.068413911
Topological Polar Surface Area43.1 Ų
Heavy Atom Count13
Formal Charge0
Complexity193
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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