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Chemical structure of trans-Cinnamic acid-d7

GC74242

trans-Cinnamic acid-d7

Also known as (E)-2,3-dideuterio-3-(2,3,4,5,6-pentadeuteriophenyl)prop-2-enoic acid

trans-Cinnamic acid-d7 is the deuterium labeled trans-Cinnamic acid

ChemicalCAS343338-31-8MW155.2FormulaC9HD7O2
CAS number
343338-31-8
Molecular weight
155.2
Formula
C9HD7O2
Solubility
DMSO ： 100 mg/mL (644·33 mM; Need ultrasonic and warming)
InChIKey
WBYWAXJHAXSJNI-UJMUNGNDSA-N
Catalogue number
GC74242
Brand
GLPBIO
Computed properties PubChem CID 16213746 · XLogP 2.1 · TPSA 37.3 Ų · H-bond donors 1
XLogP
2.1
TPSA
37.3 Ų
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
2
Heavy atoms
11

SMILES [2H]C1=C(C(=C(C(=C1[2H])[2H])/C(=C(\[2H])/C(=O)O)/[2H])[2H])[2H]

Computed descriptors from PubChem (CID 16213746), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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