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2-bromo Deschloroketamine

CAT: 1459-CS-O-63287Size: 1 EachDry Ice: NoHazardous: No
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CAT#:1459-CS-O-63287Size:1 Each
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Description
2-bromo Deschloroketamine is listed under Impurity and is intended for research and analytical applications. It is associated with ketamine. This is a controlled substance entry for enquiry only. Any possible supply discussion is subject to due diligence, certification, permits, documentation, intended end-use and applicable compliance review. This controlled substance entry is shown for qualified research enquiry and compliance review, with product information including CAS number, molecular formula, molecular weight and enquiry details.
Overview
Useful research chemical for a range of applications.
CAS Number
120807-70-7
Synonyms
2-bromo Deschloroketamine
Molecular Formula
C 13 H 16 BrNO
Molecular Weight
282.18
Additionnal Information
2-bromo Deschloroketamine is a controlled substance reference entry. Enquiries are reviewed for organization details, intended end-use, certifications, permits, documentation and applicable legal requirements before any possible supply discussion.
Storage Conditions
Refer MSDS for complete information.
Applications Notes
Useful research chemical for a range of applications.
HSN Code
38229010
Hazard Compound
Refer MSDS for complete information.

Chemical Information

2-Bromodeschloroketamine
CAS Number120807-70-7
PubChem CID71588007
IUPAC Name2-(2-bromophenyl)-2-(methylamino)cyclohexan-1-one
Molecular FormulaC13H16BrNO
Molecular Weight282.18
XLogP2.2
Topological Polar Surface Area29.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Heavy Atom Count16
Formal Charge0
Complexity269
SMILES
CNC1(CCCCC1=O)C2=CC=CC=C2Br
InChI
InChI=1S/C13H16BrNO/c1-15-13(9-5-4-8-12(13)16)10-6-2-3-7-11(10)14/h2-3,6-7,15H,4-5,8-9H2,1H3
InChIKey
XPMMBFIMXKSQIQ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-Bromodeschloroketamine
CAS: 120807-70-7
CID: 71588007
Formula: C13H16BrNO
MW: 282.18
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight282.18
XLogP32.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Exact Mass281.04153
Monoisotopic Mass281.04153
Topological Polar Surface Area29.1 Ų
Heavy Atom Count16
Formal Charge0
Complexity269
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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