AV-105

CAT: 0013-GTR19195540-02Size: 1 ml x 10 mM (in DMSO)Dry Ice: NoHazardous: No

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CAT#:0013-GTR19195540-02Size:1 ml x 10 mM (in DMSO)

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

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Description

AV-105 is a chemical precursor used in the synthesis of florbetapir (F18), the active component of the PET imaging agent Amyvid. This agent is employed in Alzheimer's disease research for the in vivo detection and quantification of amyloid-beta plaques in the brain.

CAS Number

1205550-99-7

Product Name Alternative

AV105, AV-105, AV 105

Purity

99.76% (May vary between batches)

Solubility

DMSO:50 mg/mL (81.6 mM)

Smiles

S (OCCOCCOCCOC1=CC=C (/C=C/C2=CC=C (N (C (OC (C) (C) C) =O) C) C=C2) C=N1) (=O) (=O) C3=CC=C (C) C=C3

Molecular Formula

C32H40N2O8S

Molecular Weight

612.73

Storage Conditions

-20°C

Notes

For research use only.

Chemical Information

Deflouro-(p-tolylsulfonyloxy)-N-boc-florbetapir

CAS Number	1205550-99-7
PubChem CID	46842948
IUPAC Name	2-[2-[2-[[5-[(E)-2-[4-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]phenyl]ethenyl]-2-pyridinyl]oxy]ethoxy]ethoxy]ethyl 4-methylbenzenesulfonate
Molecular Formula	C32H40N2O8S
Molecular Weight	612.7
XLogP	5.2
Topological Polar Surface Area	122
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	9
Rotatable Bond Count	17
Heavy Atom Count	43
Formal Charge	0
Complexity	932

SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCCOCCOCCOC2=NC=C(C=C2)/C=C/C3=CC=C(C=C3)N(C)C(=O)OC(C)(C)C

InChI

InChI=1S/C32H40N2O8S/c1-25-6-15-29(16-7-25)43(36,37)41-23-21-39-19-18-38-20-22-40-30-17-12-27(24-33-30)9-8-26-10-13-28(14-11-26)34(5)31(35)42-32(2,3)4/h6-17,24H,18-23H2,1-5H3/b9-8+

InChIKey

MDBUGPWBKWJULZ-CMDGGOBGSA-N

Chemical Structure

2D Structure

CAS: 1205550-99-7

CID: 46842948

Formula: C32H40N2O8S

MW: 612.7

Interactive 3D Structure

Loading 3D structure...

View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	612.7
XLogP3	5.2
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	9
Rotatable Bond Count	17
Exact Mass	612.25053741
Monoisotopic Mass	612.25053741
Topological Polar Surface Area	122 Å²
Heavy Atom Count	43
Formal Charge	0
Complexity	932
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	1
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

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AV-105

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