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Sodium 2-Naphthoate

CAT: 0024-sc-487637Size: 5 gDry Ice: NoHazardous: No
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CAT#:0024-sc-487637Size:5 g
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CAS Number
17273-79-9

Chemical Information

Sodium naphthalene-2-carboxylate
CAS Number17273-79-9
PubChem CID23685274
IUPAC Namesodium naphthalene-2-carboxylate
Molecular FormulaC11H7NaO2
Molecular Weight194.16
Topological Polar Surface Area40.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Heavy Atom Count14
Formal Charge0
Complexity205
SMILES
C1=CC=C2C=C(C=CC2=C1)C(=O)[O-].[Na+]
InChI
InChI=1S/C11H8O2.Na/c12-11(13)10-6-5-8-3-1-2-4-9(8)7-10;/h1-7H,(H,12,13);/q;+1/p-1
InChIKey
WUJXROKYJRAVIO-UHFFFAOYSA-M
Chemical Structure
2D Structure
2D structure of Sodium naphthalene-2-carboxylate
CAS: 17273-79-9
CID: 23685274
Formula: C11H7NaO2
MW: 194.16
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight194.16
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Exact Mass194.03437374
Monoisotopic Mass194.03437374
Topological Polar Surface Area40.1 Ų
Heavy Atom Count14
Formal Charge0
Complexity205
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes