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SU 14074

CAT: 0931-T34729Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0931-T34729Size:25 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
3196-50-7
Target
Others
Related Pathways
Others
Bioactivity
SU 14074 is a bioactive chemical.
Smiles
[Cl-].C=1C=CC(=CC1)C23C=4C=CC=CC4C([N+](=C2C)C)CC3
Molecular Formula
C19H20ClN
Molecular Weight
297.82
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

1,4-Dihydro-2,3-dimethyl-4-phenyl-1,4-ethanoisoquinolium chloride
CAS Number3196-50-7
PubChem CID18532
IUPAC Name9,10-dimethyl-1-phenyl-9-azoniatricyclo[6.2.2.02,7]dodeca-2,4,6,9-tetraene chloride
Molecular FormulaC19H20ClN
Molecular Weight297.8
Topological Polar Surface Area3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Heavy Atom Count21
Formal Charge0
Complexity417
SMILES
CC1=[N+](C2CCC1(C3=CC=CC=C23)C4=CC=CC=C4)C.[Cl-]
InChI
InChI=1S/C19H20N.ClH/c1-14-19(15-8-4-3-5-9-15)13-12-18(20(14)2)16-10-6-7-11-17(16)19;/h3-11,18H,12-13H2,1-2H3;1H/q+1;/p-1
InChIKey
KMXCFLDVCWKIMR-UHFFFAOYSA-M
Chemical Structure
2D Structure
2D structure of 1,4-Dihydro-2,3-dimethyl-4-phenyl-1,4-ethanoisoquinolium chloride
CAS: 3196-50-7
CID: 18532
Formula: C19H20ClN
MW: 297.8
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight297.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Exact Mass297.1284273
Monoisotopic Mass297.1284273
Topological Polar Surface Area3 Ų
Heavy Atom Count21
Formal Charge0
Complexity417
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count2
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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CatalogName
GTR19192565SU 14074

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