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Flunitrazepam-d7

CAT: 1459-CS-BX-00626Size: 1 EachDry Ice: NoHazardous: No
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CAT#:1459-CS-BX-00626Size:1 Each
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Description
Flunitrazepam-d7 is listed under Stable Isotopes and is intended for research and analytical applications. It is associated with Flunitrazepam. 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
1286448-08-5
Synonyms
Flunitrazepam-d7
Molecular Formula
C 16 H 5 D 7 FN 3 O 3
Molecular Weight
320.33
Additionnal Information
Flunitrazepam-d7 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

7-nitro-5-(2,3,4,5-tetradeuterio-6-fluorophenyl)-1-(trideuteriomethyl)-3H-1,4-benzodiazepin-2-one
CAS Number1286448-08-5
PubChem CID45358984
IUPAC Name7-nitro-5-(2,3,4,5-tetradeuterio-6-fluorophenyl)-1-(trideuteriomethyl)-3H-1,4-benzodiazepin-2-one
Molecular FormulaC16H12FN3O3
Molecular Weight320.33
XLogP2.1
Topological Polar Surface Area78.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count1
Heavy Atom Count23
Formal Charge0
Complexity519
SMILES
[2H]C1=C(C(=C(C(=C1[2H])C2=NCC(=O)N(C3=C2C=C(C=C3)[N+](=O)[O-])C([2H])([2H])[2H])F)[2H])[2H]
InChI
InChI=1S/C16H12FN3O3/c1-19-14-7-6-10(20(22)23)8-12(14)16(18-9-15(19)21)11-4-2-3-5-13(11)17/h2-8H,9H2,1H3/i1D3,2D,3D,4D,5D
InChIKey
PPTYJKAXVCCBDU-AAYPNNLASA-N
Chemical Structure
2D Structure
2D structure of 7-nitro-5-(2,3,4,5-tetradeuterio-6-fluorophenyl)-1-(trideuteriomethyl)-3H-1,4-benzodiazepin-2-one
CAS: 1286448-08-5
CID: 45358984
Formula: C16H12FN3O3
MW: 320.33
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight320.33
XLogP32.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count1
Exact Mass320.13020664
Monoisotopic Mass320.13020664
Topological Polar Surface Area78.5 Ų
Heavy Atom Count23
Formal Charge0
Complexity519
Isotope Atom Count7
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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