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Chloromethylated polystyrene, 2% DVB

CAT: 0024-sc-294012BSize: 250 gDry Ice: NoHazardous: No
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CAT#:0024-sc-294012BSize:250 g
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CAS Number
70024-51-0

Chemical Information

2-(Heptan-3-yl)-5-methyl-5-nitro-1,3-dioxane
CAS Number70024-51-0
PubChem CID250520
IUPAC Name2-heptan-3-yl-5-methyl-5-nitro-1,3-dioxane
Molecular FormulaC12H23NO4
Molecular Weight245.32
XLogP3
Topological Polar Surface Area64.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Heavy Atom Count17
Formal Charge0
Complexity243
SMILES
CCCCC(CC)C1OCC(CO1)(C)[N+](=O)[O-]
InChI
InChI=1S/C12H23NO4/c1-4-6-7-10(5-2)11-16-8-12(3,9-17-11)13(14)15/h10-11H,4-9H2,1-3H3
InChIKey
FCGHBWUKOGKLKO-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-(Heptan-3-yl)-5-methyl-5-nitro-1,3-dioxane
CAS: 70024-51-0
CID: 250520
Formula: C12H23NO4
MW: 245.32
Interactive 3D Structure
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View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight245.32
XLogP33
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Exact Mass245.16270821
Monoisotopic Mass245.16270821
Topological Polar Surface Area64.3 Ų
Heavy Atom Count17
Formal Charge0
Complexity243
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
236859-01Chloromethylated polystyrene
268959-01Chloromethylated polystyrene discontinued. See 239631
239632-01Merrifield resin, 100-200 mesh (Chloromethylated polystyrene)
239634-01Merrifield resin, 200-400 mesh (Chloromethylated polystyrene)
MBS406624-01Chloromethylated Polystyrene Resin (100-200 mesh) 1% DVB
RCM-1054-PI-01Chloromethylated Polystyrene Resin (200-400 mesh) 1% DVB
MBS406741-01Chloromethylated Polystyrene Resin (200-400 mesh) 2% DVB
FC29917Chloromethylated polystyrene - 0.8-1.5meq/g, 100-200Mesh
236861-01Chloromethylated Polystyrene, 2%, 2.0-4.5meq/g, 200-400mesh (Merrifield Resin)
FP171383-01Polystyrene

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