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Chrysoidine R

CAT: 0013-GTR19244924-02Size: 250 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19244924-02Size:250 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
Chrysoidine R is a biochemical reagent that can be used as a biomaterial for life science related research and as a sulfonylation reagent for organic synthesis and drug discovery.
CAS Number
4438-16-8
Smiles
Cl.N (=NC=1C=C (C (N) =CC1N) C) C=2C=CC=CC2
Molecular Formula
C13H15ClN4
Molecular Weight
262.74
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

1,3-Benzenediamine, 4-methyl-6-(2-phenyldiazenyl)-, hydrochloride (1:1)
CAS Number4438-16-8
PubChem CID78176
IUPAC Name4-methyl-6-phenyldiazenylbenzene-1,3-diamine;hydrochloride
Molecular FormulaC13H15ClN4
Molecular Weight262.74
Topological Polar Surface Area76.8
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Heavy Atom Count18
Formal Charge0
Complexity260
SMILES
CC1=CC(=C(C=C1N)N)N=NC2=CC=CC=C2.Cl
InChI
InChI=1S/C13H14N4.ClH/c1-9-7-13(12(15)8-11(9)14)17-16-10-5-3-2-4-6-10;/h2-8H,14-15H2,1H3;1H
InChIKey
SYGRIMFNUFCHJC-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1,3-Benzenediamine, 4-methyl-6-(2-phenyldiazenyl)-, hydrochloride (1:1)
CAS: 4438-16-8
CID: 78176
Formula: C13H15ClN4
MW: 262.74
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight262.74
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Exact Mass262.0985242
Monoisotopic Mass262.0985242
Topological Polar Surface Area76.8 Ų
Heavy Atom Count18
Formal Charge0
Complexity260
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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