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(R) - (-) -Columbianetin

CAT: 0931-T124707-01Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0931-T124707-01Size:1 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
52842-47-4
Target
Others
Related Pathways
Others
Bioactivity
(R) - (-) -Columbianetin is a useful organic compound for research related to life sciences. The catalog number is T124707 and the CAS number is 52842-47-4.
Smiles
CC(O)([C@H]1Cc(c(O1)cc2)c3c2ccc(=O)o3)C
Molecular Formula
C14H14O4
Molecular Weight
246.262
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

(8R)-8,9-Dihydro-8-(1-hydroxy-1-methylethyl)-2H-furo(2,3-h)-1-benzopyran-2-one

(R)-columbianetin is the (R)-()-enantiomer of columbianetin. It is an enantiomer of a (S)-columbianetin.

CAS Number52842-47-4
PubChem CID442104
IUPAC Name(8R)-8-(2-hydroxypropan-2-yl)-8,9-dihydrofuro[2,3-h]chromen-2-one
Molecular FormulaC14H14O4
Molecular Weight246.26
XLogP1.9
Topological Polar Surface Area55.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count1
Heavy Atom Count18
Formal Charge0
Complexity387
SMILES
CC(C)([C@H]1CC2=C(O1)C=CC3=C2OC(=O)C=C3)O
InChI
InChI=1S/C14H14O4/c1-14(2,16)11-7-9-10(17-11)5-3-8-4-6-12(15)18-13(8)9/h3-6,11,16H,7H2,1-2H3/t11-/m1/s1
InChIKey
YRAQEMCYCSSHJG-LLVKDONJSA-N
Chemical Structure
2D Structure
2D structure of (8R)-8,9-Dihydro-8-(1-hydroxy-1-methylethyl)-2H-furo(2,3-h)-1-benzopyran-2-one
CAS: 52842-47-4
CID: 442104
Formula: C14H14O4
MW: 246.26
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight246.26
XLogP31.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count1
Exact Mass246.08920892
Monoisotopic Mass246.08920892
Topological Polar Surface Area55.8 Ų
Heavy Atom Count18
Formal Charge0
Complexity387
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
268675-01(+) -Columbianetin
MBS5758256Columbianetin
GTR19220193-01(±) -Columbianetin
TRC-C642500-250MG(+)-Columbianetin
MBS5817568(+/-)-Columbianetin
440839-01Acetyl Columbianetin
MBS5751416COLUMBIANETIN ACETATE
M38654Columbianetin b
BUP04413-01(+) -Columbianetin acetate
HY-N12968R- (-) -Columbianetin

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