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Xylonidine

CAT: 0931-T35203-02Size: 500 mgDry Ice: NoHazardous: No
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CAT#:0931-T35203-02Size:500 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
4859-06-7
Target
Others
Related Pathways
Others
Bioactivity
Xylonidine is a biochemical.
Smiles
N1=C(NC=2C(=CC=CC2C)C)NCC1
Molecular Formula
C11H15N3
Molecular Weight
189.26
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Xylonidine

alpha adrenoreceptor stimulation by above cpd mainly inhibits the release of mediator and/or the bronchoconstriction caused by moderate activation of sensory nerves; forced molting agent; structure given in first source

CAS Number4859-06-7
PubChem CID78576
IUPAC NameN-(2,6-dimethylphenyl)-4,5-dihydro-1H-imidazol-2-amine
Molecular FormulaC11H15N3
Molecular Weight189.26
XLogP1.4
Topological Polar Surface Area36.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count1
Rotatable Bond Count2
Heavy Atom Count14
Formal Charge0
Complexity215
SMILES
CC1=C(C(=CC=C1)C)NC2=NCCN2
InChI
InChI=1S/C11H15N3/c1-8-4-3-5-9(2)10(8)14-11-12-6-7-13-11/h3-5H,6-7H2,1-2H3,(H2,12,13,14)
InChIKey
IVCKBWZBJVLCDH-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Xylonidine
CAS: 4859-06-7
CID: 78576
Formula: C11H15N3
MW: 189.26
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight189.26
XLogP31.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count1
Rotatable Bond Count2
Exact Mass189.126597491
Monoisotopic Mass189.126597491
Topological Polar Surface Area36.4 Ų
Heavy Atom Count14
Formal Charge0
Complexity215
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

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