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N-nitroso codeine EP impurity H

CAT: 1459-CS-O-57304Size: 1 EachDry Ice: NoHazardous: No
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Description
N-nitroso codeine EP impurity H is listed under Nitrosamine and is intended for research and analytical applications. It is associated with codeine. 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
77774-24-4
Synonyms
N-nitroso codeine EP impurity H
Molecular Formula
C 17 H 18 N 2 O 4
Molecular Weight
314.34
Additionnal Information
N-nitroso codeine EP impurity H 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

3-Methoxy-17-nitroso-7,8-didehydro-4,5-epoxymorphinan-6-ol
CAS Number77774-24-4
PubChem CID281725
IUPAC Name9-methoxy-3-nitroso-2,4,4a,7,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-7-ol
Molecular FormulaC17H18N2O4
Molecular Weight314.34
XLogP1.1
Topological Polar Surface Area71.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count1
Heavy Atom Count23
Formal Charge0
Complexity555
SMILES
COC1=C2C3=C(CC4C5C3(CCN4N=O)C(O2)C(C=C5)O)C=C1
InChI
InChI=1S/C17H18N2O4/c1-22-13-5-2-9-8-11-10-3-4-12(20)16-17(10,6-7-19(11)18-21)14(9)15(13)23-16/h2-5,10-12,16,20H,6-8H2,1H3
InChIKey
NGNCKOKHKZDIHF-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 3-Methoxy-17-nitroso-7,8-didehydro-4,5-epoxymorphinan-6-ol
CAS: 77774-24-4
CID: 281725
Formula: C17H18N2O4
MW: 314.34
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight314.34
XLogP31.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count1
Exact Mass314.12665706
Monoisotopic Mass314.12665706
Topological Polar Surface Area71.4 Ų
Heavy Atom Count23
Formal Charge0
Complexity555
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count5
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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