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Chemical structure of Alprazolam-d5 (CRM)

GC48773

Alprazolam-d5 (CRM)

Also known as 8-chloro-1-methyl-6-(2,3,4,5,6-pentadeuteriophenyl)-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine

A Certified Reference Material

ChemicalCAS125229-61-0MW313.8FormulaC17H8D5ClN4
CAS number
125229-61-0
Molecular weight
313.8
Formula
C17H8D5ClN4
InChIKey
VREFGVBLTWBCJP-VIQYUKPQSA-N
Catalogue number
GC48773
Brand
GLPBIO
Computed properties PubChem CID 45358907 · XLogP 2.1 · TPSA 43.1 Ų · H-bond donors 0
XLogP
2.1
TPSA
43.1 Ų
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
22

SMILES [2H]C1=C(C(=C(C(=C1[2H])[2H])C2=NCC3=NN=C(N3C4=C2C=C(C=C4)Cl)C)[2H])[2H]

Computed descriptors from PubChem (CID 45358907), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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