Hydroxy Tyrosol-d3

CAT: 1596-AR-T06268-06Size: 250 UnitsDry Ice: NoHazardous: No

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CAT#:1596-AR-T06268-06Size:250 Units

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CAS Number

294660-90-5

Molecular Formula

C8H7D3O3

Molecular Weight

157.18

API Name

Tyrosol

Chemical Information

3,4,6-Trideuterio-5-(2-hydroxyethyl)benzene-1,2-diol

CAS Number	294660-90-5
PubChem CID	10844647
IUPAC Name	3,4,6-trideuterio-5-(2-hydroxyethyl)benzene-1,2-diol
Molecular Formula	C8H10O3
Molecular Weight	157.18
XLogP	-0.7
Topological Polar Surface Area	60.7
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	2
Heavy Atom Count	11
Formal Charge	0
Complexity	116

SMILES

[2H]C1=C(C(=C(C(=C1CCO)[2H])O)O)[2H]

InChI

InChI=1S/C8H10O3/c9-4-3-6-1-2-7(10)8(11)5-6/h1-2,5,9-11H,3-4H2/i1D,2D,5D

InChIKey

JUUBCHWRXWPFFH-FYFKOAPZSA-N

Chemical Structure

2D Structure

CAS: 294660-90-5

CID: 10844647

Formula: C8H10O3

MW: 157.18

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	157.18
XLogP3	-0.7
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	2
Exact Mass	157.081824415
Monoisotopic Mass	157.081824415
Topological Polar Surface Area	60.7 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	116
Isotope Atom Count	3
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
ULA66090-01	Hydroxy tyrosol-d3
MBS6057641-01	Hydroxy Tyrosol
UCA03902-01	Hydroxy Tyrosol ±-Acetate
sc-488671	Hydroxy Tyrosol-d4
TRC-H977000-5G	Hydroxy Tyrosol (>85%)
TRC-H977005-1G	Hydroxy Tyrosol a-Acetate
ESS0219-01	Hydroxy Tyrosol-D5
452064-01	Hydroxy Tyrosol (>98%, Synthetic)
TRC-H977005-100MG	Hydroxy Tyrosol alpha-Acetate
452065-01	Hydroxy Tyrosol Sulfate Triethylammonium Salt