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BDP 581/591 alkyne

CAT: 0931-T85820-01Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0931-T85820-01Size:100 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
2006345-34-0
Target
Others
Related Pathways
Others
Bioactivity
BDP 581/591 alkyne, a moderately hydrophobic borondipyrromethene fluorophore, is designed for specialized applications requiring specific fluorescent properties.
Smiles
O=C(NCC#C)CCC=1C=CC2=CC3=CC=C(C=CC=CC=4C=CC=CC4)[N-]3[B+3]([F-])([F-])[N]21
Molecular Formula
C25H22BF2N3O
Molecular Weight
429.27
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

BDP 581/591 alkyne
CAS Number2006345-34-0
PubChem CID131954327
IUPAC Name3-[2,2-difluoro-12-[(1E,3E)-4-phenylbuta-1,3-dienyl]-3-aza-1-azonia-2-boranuidatricyclo[7.3.0.03,7]dodeca-1(12),4,6,8,10-pentaen-4-yl]-N-prop-2-ynylpropanamide
Molecular FormulaC25H22BF2N3O
Molecular Weight429.3
Topological Polar Surface Area37
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count7
Heavy Atom Count32
Formal Charge0
Complexity934
SMILES
[B-]1(N2C(=CC=C2CCC(=O)NCC#C)C=C3[N+]1=C(C=C3)/C=C/C=C/C4=CC=CC=C4)(F)F
InChI
InChI=1S/C25H22BF2N3O/c1-2-18-29-25(32)17-16-22-13-15-24-19-23-14-12-21(30(23)26(27,28)31(22)24)11-7-6-10-20-8-4-3-5-9-20/h1,3-15,19H,16-18H2,(H,29,32)/b10-6+,11-7+
InChIKey
OLFSHALJABVHGP-JMQWPVDRSA-N
Chemical Structure
2D Structure
2D structure of BDP 581/591 alkyne
CAS: 2006345-34-0
CID: 131954327
Formula: C25H22BF2N3O
MW: 429.3
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight429.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count7
Exact Mass429.1823988
Monoisotopic Mass429.1823988
Topological Polar Surface Area37 Ų
Heavy Atom Count32
Formal Charge0
Complexity934
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count2
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
T208379-01BDP 581/591 DBCO
T85824-01BDP 581/591 maleimide
T85822-01BDP 581/591 azide
T206533-01BDP 581/591 hydrazide hydrochloride
T75374-01BDP 581/591 NHS ester
T85823-01BDP 581/591 carboxylic acid
T85821-01BDP 581/591 amine hydrochloride
T39652-01BODIPY 581/591 C11
T85893-01BODIPY-581/591 NHS ester
T208380-01BDP 558/568 alkyne

Alternative Products

CatalogName
BIPG1971-01BDP 581/591 alkyne
B64B0BDP® 581/591 alkyne, 5 mg
D64B0BDP® 581/591 alkyne, 25 mg
C64B0BDP® 581/591 alkyne, 10 mg
E64B0BDP® 581/591 alkyne, 50 mg
A64B0BDP® 581/591 alkyne, 1 mg
F64B0BDP® 581/591 alkyne, 100 mg
KWK1415_1 mgFlamma® 581 Alkyne
KWG1415_25 mgFlamma® 581 PEG4-Alkyne
M35138-01BODIPY 581/591 C11

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