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Br-Mmc

CAT: 0013-GTR19155259-02Size: 500 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19155259-02Size:500 mg
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Description
Br-Mmc is used as a new fluorescence label for fatty acids. It is used for the determination of fatty acids by HPLC or TLC.
CAS Number
35231-44-8
Product Name Alternative
4-Bromomethyl-7-methoxycoumarin
Purity
>98% (HPLC)
Solubility
DMSO:10 mM
Smiles
O=C1C=C (CBr) C2=CC=C (OC) C=C2O1
Molecular Formula
C11H9BrO3
Molecular Weight
269.09
Storage Conditions
Storage temperature: -20°C. Stability: ≥ 2 years
Notes
For research use only.

Chemical Information

4-Bromomethyl-7-methoxycoumarin
CAS Number35231-44-8
PubChem CID121894
IUPAC Name4-(bromomethyl)-7-methoxychromen-2-one
Molecular FormulaC11H9BrO3
Molecular Weight269.09
XLogP2.4
Topological Polar Surface Area35.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Heavy Atom Count15
Formal Charge0
Complexity288
SMILES
COC1=CC2=C(C=C1)C(=CC(=O)O2)CBr
InChI
InChI=1S/C11H9BrO3/c1-14-8-2-3-9-7(6-12)4-11(13)15-10(9)5-8/h2-5H,6H2,1H3
InChIKey
CTENSLORRMFPDH-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 4-Bromomethyl-7-methoxycoumarin
CAS: 35231-44-8
CID: 121894
Formula: C11H9BrO3
MW: 269.09
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight269.09
XLogP32.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Exact Mass267.97351
Monoisotopic Mass267.97351
Topological Polar Surface Area35.5 Ų
Heavy Atom Count15
Formal Charge0
Complexity288
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

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