Products for Research Use Only
RegisterLogin

Coumarin 99% For Synthesis

CAT: 1278-00877 00250Size: 250 gDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:1278-00877 00250Size:250 g
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
91-64-5
HS Code
29322010
Packaging Group
PB

Chemical Information

Coumarin

Coumarin is a chromenone having the keto group located at the 2-position. It has a role as a fluorescent dye, a plant metabolite and a human metabolite.

CAS Number91-64-5
PubChem CID323
IUPAC Namechromen-2-one
Molecular FormulaC9H6O2
Molecular Weight146.14
XLogP1.4
Topological Polar Surface Area26.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Heavy Atom Count11
Formal Charge0
Complexity196
SMILES
C1=CC=C2C(=C1)C=CC(=O)O2
InChI
InChI=1S/C9H6O2/c10-9-6-5-7-3-1-2-4-8(7)11-9/h1-6H
InChIKey
ZYGHJZDHTFUPRJ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Coumarin
CAS: 91-64-5
CID: 323
Formula: C9H6O2
MW: 146.14
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight146.14
XLogP31.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Exact Mass146.036779430
Monoisotopic Mass146.036779430
Topological Polar Surface Area26.3 Ų
Heavy Atom Count11
Formal Charge0
Complexity196
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

Related Products

CatalogName
01238 02500Fluorobenzene 99% For Synthesis
00915 00500Cyclohexylamine 99% For Synthesis
00918 00500Cyclopentanol 99% For Synthesis
02275 00100Salicylaldehyde 99% For Synthesis
00709 00500Cellosolve 99% For Synthesis
01399 00500Hydroquinone 99% For Synthesis
00915 02500Cyclohexylamine 99% For Synthesis
00381 00250Benzoin 99% For Synthesis
00978 00500Dicyclohexylamine 99% For Synthesis
02684 00100Thiophene 99% For Synthesis

Alternative Products

CatalogName
027816-01Coumarin for Synthesis
00877 00500Coumarin 99% For Synthesis
CS080-056Custom Peptide Synthesis, Fluorescence Dye Labeling, Coumarin
300114Coumarin

Popular Products