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2-Acridinesulfonic acid

CAT: 0931-T29332-01Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0931-T29332-01Size:100 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
96460-82-1
Target
Others
Related Pathways
Others
Bioactivity
2-Acridinesulfonic acid is a biochemical.
Smiles
O=S(=O)(O)C=1C=CC2=NC=3C=CC=CC3C=C2C1
Molecular Formula
C13H9NO3S
Molecular Weight
259.28
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

2-Acridinesulfonic acid
CAS Number96460-82-1
PubChem CID3024577
IUPAC Nameacridine-2-sulfonic acid
Molecular FormulaC13H9NO3S
Molecular Weight259.28
XLogP2
Topological Polar Surface Area75.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count1
Heavy Atom Count18
Formal Charge0
Complexity403
SMILES
C1=CC=C2C(=C1)C=C3C=C(C=CC3=N2)S(=O)(=O)O
InChI
InChI=1S/C13H9NO3S/c15-18(16,17)11-5-6-13-10(8-11)7-9-3-1-2-4-12(9)14-13/h1-8H,(H,15,16,17)
InChIKey
VPDHPIXLWQMFFQ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-Acridinesulfonic acid
CAS: 96460-82-1
CID: 3024577
Formula: C13H9NO3S
MW: 259.28
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight259.28
XLogP32
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count1
Exact Mass259.03031432
Monoisotopic Mass259.03031432
Topological Polar Surface Area75.6 Ų
Heavy Atom Count18
Formal Charge0
Complexity403
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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