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Me6BIO

CAT: 0498-bs-75645C-01Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0498-bs-75645C-01Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
667463-95-8
Conjugation
Unconjugated
Purity
>95% (NMR)
Buffer
Solid
Solubility
Soluble in DMSO or ethanol.
Smiles
CN1C(=O)\C(=C2/NC3=CC=CC=C3/C/2=N\O)C2=C1C=C(Br)C=C2
Molecular Formula
C17H12BrN3O2
Molecular Weight
370.2
Storage Conditions
Stable for 2 years after receipt when stored at -20°C.
Appearance
Dark red solid.

Chemical Information

MeBIO
CAS Number667463-95-8
PubChem CID135524908
IUPAC Name6-bromo-1-methyl-3-(3-nitroso-1H-indol-2-yl)indol-2-ol
Molecular FormulaC17H12BrN3O2
Molecular Weight370.2
XLogP3.8
Topological Polar Surface Area70.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Heavy Atom Count23
Formal Charge0
Complexity465
SMILES
CN1C2=C(C=CC(=C2)Br)C(=C1O)C3=C(C4=CC=CC=C4N3)N=O
InChI
InChI=1S/C17H12BrN3O2/c1-21-13-8-9(18)6-7-11(13)14(17(21)22)16-15(20-23)10-4-2-3-5-12(10)19-16/h2-8,19,22H,1H3
InChIKey
PIDGGJYETVQYET-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of MeBIO
CAS: 667463-95-8
CID: 135524908
Formula: C17H12BrN3O2
MW: 370.2
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight370.2
XLogP33.8
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Exact Mass369.01129
Monoisotopic Mass369.01129
Topological Polar Surface Area70.4 Ų
Heavy Atom Count23
Formal Charge0
Complexity465
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
GL4627-25mgMe6BIO

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