(R) - (+) -Styrene-d5 Oxide

CAT: 0024-sc-474432Size: 5 mgDry Ice: NoHazardous: No

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CAT#:0024-sc-474432Size:5 mg

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CAS Number

192506-02-8

Chemical Information

(R)-(+)-Styrene-d5 Oxide

CAS Number	192506-02-8
PubChem CID	71752248
IUPAC Name	(2R)-2-(2,3,4,5,6-pentadeuteriophenyl)oxirane
Molecular Formula	C8H8O
Molecular Weight	125.18
XLogP	1.6
Topological Polar Surface Area	12.5
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	1
Heavy Atom Count	9
Formal Charge	0
Complexity	94

SMILES

[2H]C1=C(C(=C(C(=C1[2H])[2H])[C@@H]2CO2)[2H])[2H]

InChI

InChI=1S/C8H8O/c1-2-4-7(5-3-1)8-6-9-8/h1-5,8H,6H2/t8-/m0/s1/i1D,2D,3D,4D,5D

InChIKey

AWMVMTVKBNGEAK-HRVDQBBZSA-N

Chemical Structure

2D Structure

CAS: 192506-02-8

CID: 71752248

Formula: C8H8O

MW: 125.18

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	125.18
XLogP3	1.6
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	1
Exact Mass	125.088898604
Monoisotopic Mass	125.088898604
Topological Polar Surface Area	12.5 Å²
Heavy Atom Count	9
Formal Charge	0
Complexity	94.7
Isotope Atom Count	5
Defined Atom Stereocenter Count	1
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes