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SU 2941

CAT: 0931-T34732-02Size: 500 mgDry Ice: NoHazardous: No
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CAT#:0931-T34732-02Size:500 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
6334-87-8
Target
Others
Related Pathways
Others
Bioactivity
SU 2941 is a bioactive chemical.
Smiles
ClC1=C(C(Cl)=C(C2=C1C[N+](CC[N+](CC)(C)CC)(C2)C)Cl)Cl.[I-].[I-]
Molecular Formula
C16H24Cl4I2N2
Molecular Weight
640
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

SU 2941
CAS Number6334-87-8
PubChem CID22798
IUPAC Namediethyl-methyl-[2-(4,5,6,7-tetrachloro-2-methyl-1,3-dihydroisoindol-2-ium-2-yl)ethyl]azanium diiodide
Molecular FormulaC16H24Cl4I2N2
Molecular Weight640.0
Topological Polar Surface Area0
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count5
Heavy Atom Count24
Formal Charge0
Complexity366
SMILES
CC[N+](C)(CC)CC[N+]1(CC2=C(C1)C(=C(C(=C2Cl)Cl)Cl)Cl)C.[I-].[I-]
InChI
InChI=1S/C16H24Cl4N2.2HI/c1-5-21(3,6-2)7-8-22(4)9-11-12(10-22)14(18)16(20)15(19)13(11)17;;/h5-10H2,1-4H3;2*1H/q+2;;/p-2
InChIKey
BJYBJYYHZYGRIW-UHFFFAOYSA-L
Chemical Structure
2D Structure
2D structure of SU 2941
CAS: 6334-87-8
CID: 22798
Formula: C16H24Cl4I2N2
MW: 640.0
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight640.0
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count5
Exact Mass639.87535
Monoisotopic Mass637.87830
Topological Polar Surface Area0 Ų
Heavy Atom Count24
Formal Charge0
Complexity366
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count3
Compound Is CanonicalizedYes

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