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MitoP

CAT: 0013-GTR19190691-01Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19190691-01Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
MitoP
CAS Number
74597-01-6
Field of Research
Immunology & Inflammation, Metabolism Research, Signal Transduction
Smiles
[Br-].OC1=CC=CC (=C1) C[P+] (C=2C=CC=CC2) (C=3C=CC=CC3) C=4C=CC=CC4
Molecular Formula
C25H22BrOP
Molecular Weight
449.32
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

MitoP
CAS Number74597-01-6
PubChem CID85990242
IUPAC Name(3-hydroxyphenyl)methyl-triphenylphosphanium bromide
Molecular FormulaC25H22BrOP
Molecular Weight449.3
Topological Polar Surface Area20.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count5
Heavy Atom Count28
Formal Charge0
Complexity386
SMILES
C1=CC=C(C=C1)[P+](CC2=CC(=CC=C2)O)(C3=CC=CC=C3)C4=CC=CC=C4.[Br-]
InChI
InChI=1S/C25H21OP.BrH/c26-22-12-10-11-21(19-22)20-27(23-13-4-1-5-14-23,24-15-6-2-7-16-24)25-17-8-3-9-18-25;/h1-19H,20H2;1H
InChIKey
SVALDZORJHFRCU-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of MitoP
CAS: 74597-01-6
CID: 85990242
Formula: C25H22BrOP
MW: 449.3
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight449.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count5
Exact Mass448.05916
Monoisotopic Mass448.05916
Topological Polar Surface Area20.2 Ų
Heavy Atom Count28
Formal Charge0
Complexity386
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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