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9-Methyl-9H-beta-carboline

CAT: 1410-M32606Size: 1 EachDry Ice: NoHazardous: No
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Description
The herbs of Rauvolfia verticillata.
CAS Number
2521-07-5
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
182.2
Molecular Formula
C12H10N2
Notes
Research use only, not for human use.
Receptor
——

Chemical Information

9-Methyl-beta-carboline

structure in first source

CAS Number2521-07-5
PubChem CID164979
IUPAC Name9-methylpyrido[3,4-b]indole
Molecular FormulaC12H10N2
Molecular Weight182.22
XLogP2.3
Topological Polar Surface Area17.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Heavy Atom Count14
Formal Charge0
Complexity216
SMILES
CN1C2=CC=CC=C2C3=C1C=NC=C3
InChI
InChI=1S/C12H10N2/c1-14-11-5-3-2-4-9(11)10-6-7-13-8-12(10)14/h2-8H,1H3
InChIKey
MABOIYXDALNSES-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 9-Methyl-beta-carboline
CAS: 2521-07-5
CID: 164979
Formula: C12H10N2
MW: 182.22
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight182.22
XLogP32.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Exact Mass182.084398327
Monoisotopic Mass182.084398327
Topological Polar Surface Area17.8 Ų
Heavy Atom Count14
Formal Charge0
Complexity216
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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