BDP TMR carboxylic acid

Catelog Number	F01-0020
Category	BODIPY
Molecular Formula	C21H21BF2N2O3
Molecular Weight	398.21

Catalog Number	Size	Price	Quantity
F01-0020	--	$--

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Product Introduction

This free carboxylic acid can be used as a non-reactive control in side-by side experiments with other reactive derivatives of BDP TMR. It can also be used for Steglich esterification.

Chemical Information
Purity	NMR 1H, HPLC-MS (95%)
IUPAC Name	3-[2,2-difluoro-12-(4-methoxyphenyl)-4,6-dimethyl-1-aza-3-azonia-2-boranuidatricyclo[7.3.0.03,7]dodeca-3,5,7,9,11-pentaen-5-yl]propanoic acid
Canonical SMILES	[B-]1(N2C(=CC=C2C3=CC=C(C=C3)OC)C=C4[N+]1=C(C(=C4C)CCC(=O)O)C)(F)F
InChI	InChI=1S/C21H21BF2N2O3/c1-13-18(9-11-21(27)28)14(2)25-20(13)12-16-6-10-19(26(16)22(25,23)24)15-4-7-17(29-3)8-5-15/h4-8,10,12H,9,11H2,1-3H3,(H,27,28)
InChI Key	XNXZTGCQHQKUMJ-UHFFFAOYSA-N
Solubility	good in alcohols, DMSO, DMF
Appearance	dark green-black crystals

Product Specification
Fluorescence Quantum Yield	0.95
Excitation	545
Emission	570
Storage	24 months after receival at -20°C in the dark. Transportation: at room temperature for up to 3 weeks. Avoid prolonged exposure to light. Desiccate.

Computed Properties
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	5
Exact Mass	398.1613290 g/mol
Monoisotopic Mass	398.1613290 g/mol
Topological Polar Surface Area	54.5Å²
Heavy Atom Count	29
Formal Charge	0
Complexity	800
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

Applications of Fluorescent Probes & Dyes

Laser Dye

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BDP TMR carboxylic acid

Product Introduction

Chemical Information

Product Specification

Computed Properties