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Sodium Benzenethiolate (technical grade, 90%)

CAT: 0572-TRC-S930690-1GSize: 1 gDry Ice: NoHazardous: No
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CAT#:0572-TRC-S930690-1GSize:1 g
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
930-69-8
Synonyms
Sodium Phenylmercaptide; Sodium Phenylsulfide; Sodium Phenylthiolate; Sodium Thiophenate; Sodium Thiophenolate; Sodium Thiophenoxide; Sodium Thiophenylate; Thiophenol Sodium Salt; Thiophenyl Sodium Salt;
Hazard Statement
No Data Available
Smiles
[Na+].[S-]c1ccccc1
Molecular Formula
C6H5NaS
Molecular Weight
132.16
Shipping Conditions
Room Temperature
Storage Conditions
-20°C

Chemical Information

Sodium benzenethiolate
CAS Number930-69-8
PubChem CID4110039
IUPAC Namesodium benzenethiolate
Molecular FormulaC6H5NaS
Molecular Weight132.16
Topological Polar Surface Area1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Heavy Atom Count8
Formal Charge0
Complexity50
SMILES
C1=CC=C(C=C1)[S-].[Na+]
InChI
InChI=1S/C6H6S.Na/c7-6-4-2-1-3-5-6;/h1-5,7H;/q;+1/p-1
InChIKey
RZWQDAUIUBVCDD-UHFFFAOYSA-M
Chemical Structure
2D Structure
2D structure of Sodium benzenethiolate
CAS: 930-69-8
CID: 4110039
Formula: C6H5NaS
MW: 132.16
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight132.16
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Exact Mass132.00096561
Monoisotopic Mass132.00096561
Topological Polar Surface Area1 Ų
Heavy Atom Count8
Formal Charge0
Complexity50.5
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

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