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2-Nitro-1-naphthol

CAT: 0024-sc-230577Size: 5 gDry Ice: NoHazardous: No
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CAT#:0024-sc-230577Size:5 g
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CAS Number
607-24-9

Chemical Information

2-Nitro-1-naphthol
CAS Number607-24-9
PubChem CID69083
IUPAC Name2-nitronaphthalen-1-ol
Molecular FormulaC10H7NO3
Molecular Weight189.17
XLogP2.9
Topological Polar Surface Area66.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count0
Heavy Atom Count14
Formal Charge0
Complexity226
SMILES
C1=CC=C2C(=C1)C=CC(=C2O)[N+](=O)[O-]
InChI
InChI=1S/C10H7NO3/c12-10-8-4-2-1-3-7(8)5-6-9(10)11(13)14/h1-6,12H
InChIKey
MUCCHGOWMZTLHK-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-Nitro-1-naphthol
CAS: 607-24-9
CID: 69083
Formula: C10H7NO3
MW: 189.17
Interactive 3D Structure
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Computed Properties
PropertyValue
Molecular Weight189.17
XLogP32.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count0
Exact Mass189.042593085
Monoisotopic Mass189.042593085
Topological Polar Surface Area66.1 Ų
Heavy Atom Count14
Formal Charge0
Complexity226
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