Calcein

CAT: 0931-T14855-01Size: 50 mgDry Ice: NoHazardous: No

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CAT#:0931-T14855-01Size:50 mg

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

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CAS Number

1461-15-0

Target

Others

Related Pathways

Others

Purity

≥98%

Bioactivity

Calcein (Fluorexon) is a fluorescent dye and self-quenching probe used as an indicator of lipid vesicle leakage, a complexometric indicator for titration of calcium ions with EDTA, and for the fluorometric determination of calcium.

Smiles

OC(=O)CN(CC(O)=O)Cc1cc2c(Oc3cc(O)c(CN(CC(O)=O)CC(O)=O)cc3C22OC(=O)c3ccccc23)cc1O

Molecular Formula

C30H26N2O13

Molecular Weight

622.53

Shipping Conditions

Ice Packs

Storage Temperature

-20°C

Chemical Information

Calcein

Calcein is a xanthene dye. It has a role as a fluorochrome. It is functionally related to a fluoran.

CAS Number	1461-15-0
PubChem CID	65079
IUPAC Name	2-[[7'-[[bis(carboxymethyl)amino]methyl]-3',6'-dihydroxy-3-oxospiro[2-benzofuran-1,9'-xanthene]-2'-yl]methyl-(carboxymethyl)amino]acetic acid
Molecular Formula	C30H26N2O13
Molecular Weight	622.5
XLogP	-3.1
Topological Polar Surface Area	232
Hydrogen Bond Donor Count	6
Hydrogen Bond Acceptor Count	15
Rotatable Bond Count	12
Heavy Atom Count	45
Formal Charge	0
Complexity	1070

SMILES

C1=CC=C2C(=C1)C(=O)OC23C4=C(C=C(C(=C4)CN(CC(=O)O)CC(=O)O)O)OC5=C3C=C(C(=C5)O)CN(CC(=O)O)CC(=O)O

InChI

InChI=1S/C30H26N2O13/c33-21-7-23-19(5-15(21)9-31(11-25(35)36)12-26(37)38)30(18-4-2-1-3-17(18)29(43)45-30)20-6-16(22(34)8-24(20)44-23)10-32(13-27(39)40)14-28(41)42/h1-8,33-34H,9-14H2,(H,35,36)(H,37,38)(H,39,40)(H,41,42)

InChIKey

DEGAKNSWVGKMLS-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1461-15-0

CID: 65079

Formula: C30H26N2O13

MW: 622.5

Interactive 3D Structure

Loading 3D structure...

View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	622.5
XLogP3	-3.1
Hydrogen Bond Donor Count	6
Hydrogen Bond Acceptor Count	15
Rotatable Bond Count	12
Exact Mass	622.14348889
Monoisotopic Mass	622.14348889
Topological Polar Surface Area	232 Å²
Heavy Atom Count	45
Formal Charge	0
Complexity	1070
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

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561699	Calcein
B7755-.5	Calcein AM (Calcein acetoxymethyl ester)

Calcein

Chemical Information

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