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Calcein Blue

CAT: 0931-T18933-02Size: 1 mL - 10 mM (in DMSO)Dry Ice: NoHazardous: No
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CAT#:0931-T18933-02Size:1 mL - 10 mM (in DMSO)
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
54375-47-2
Target
Others
Related Pathways
Others
Purity
0.9979
Bioactivity
Calcein Blue is a blue-fluorescent, short-term dye.
Smiles
Cc1cc(=O)oc2c(CN(CC(O)=O)CC(O)=O)c(O)ccc12
Molecular Formula
C15H15NO7
Molecular Weight
321.28
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

4-Methylcoumarin-6-ylmethyliminodiacetic acid
CAS Number54375-47-2
PubChem CID3085064
IUPAC Name2-[carboxymethyl-[(4-methyl-2-oxochromen-6-yl)methyl]amino]acetic acid
Molecular FormulaC15H15NO6
Molecular Weight305.28
XLogP-1.4
Topological Polar Surface Area104
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count7
Rotatable Bond Count6
Heavy Atom Count22
Formal Charge0
Complexity484
SMILES
CC1=CC(=O)OC2=C1C=C(C=C2)CN(CC(=O)O)CC(=O)O
InChI
InChI=1S/C15H15NO6/c1-9-4-15(21)22-12-3-2-10(5-11(9)12)6-16(7-13(17)18)8-14(19)20/h2-5H,6-8H2,1H3,(H,17,18)(H,19,20)
InChIKey
IJHAVNKJMOPQCG-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 4-Methylcoumarin-6-ylmethyliminodiacetic acid
CAS: 54375-47-2
CID: 3085064
Formula: C15H15NO6
MW: 305.28
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight305.28
XLogP3-1.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count7
Rotatable Bond Count6
Exact Mass305.08993720
Monoisotopic Mass305.08993720
Topological Polar Surface Area104 Ų
Heavy Atom Count22
Formal Charge0
Complexity484
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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