Calcein Blue 500mg

CAT: 0628-A19780-500Size: 500 mgDry Ice: NoHazardous: No

1 / 1

CAT#:0628-A19780-500Size:500 mg

Selected

24/48H Stock Items & 2 to 6 Weeks non Stock Items.

Quick Request Actions

CAS Number

54375-47-2

Chemical Information

4-Methylcoumarin-6-ylmethyliminodiacetic acid

CAS Number	54375-47-2
PubChem CID	3085064
IUPAC Name	2-[carboxymethyl-[(4-methyl-2-oxochromen-6-yl)methyl]amino]acetic acid
Molecular Formula	C15H15NO6
Molecular Weight	305.28
XLogP	-1.4
Topological Polar Surface Area	104
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	6
Heavy Atom Count	22
Formal Charge	0
Complexity	484

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

CAS: 54375-47-2

CID: 3085064

Formula: C15H15NO6

MW: 305.28

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	305.28
XLogP3	-1.4
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	6
Exact Mass	305.08993720
Monoisotopic Mass	305.08993720
Topological Polar Surface Area	104 Å²
Heavy Atom Count	22
Formal Charge	0
Complexity	484
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
A19780-25	Calcein Blue 25mg
A19780-10	Calcein Blue 10mg
A19780-100	Calcein Blue 100mg
A19780-50	Calcein Blue 50mg
A16612-500	Methylene Blue 500mg
A22425-500	Thiazolyl Blue 500mg
A19780-10mM-D	Calcein Blue 10mM * 1mL in DMSO
A19663-500	Nile Blue A sulfate 500mg
A18510-500	Reactive Blue 4 500mg
A21323-500	Nitro blue tetrazolium chloride 500mg