Glycidol-d5

CAT: 0024-sc-490032Size: 5 mgDry Ice: NoHazardous: No

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CAT#:0024-sc-490032Size:5 mg

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CAS Number

1246819-20-4

Chemical Information

Glycidol-d5

CAS Number	1246819-20-4
PubChem CID	71317136
IUPAC Name	dideuterio-(2,3,3-trideuteriooxiran-2-yl)methanol
Molecular Formula	C3H6O2
Molecular Weight	79.11
XLogP	-0.9
Topological Polar Surface Area	32.8
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Heavy Atom Count	5
Formal Charge	0
Complexity	35

SMILES

[2H]C1(C(O1)([2H])C([2H])([2H])O)[2H]

InChI

InChI=1S/C3H6O2/c4-1-3-2-5-3/h3-4H,1-2H2/i1D2,2D2,3D

InChIKey

CTKINSOISVBQLD-UXXIZXEISA-N

Chemical Structure

2D Structure

CAS: 1246819-20-4

CID: 71317136

Formula: C3H6O2

MW: 79.11

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	79.11
XLogP3	-0.9
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Exact Mass	79.068163160
Monoisotopic Mass	79.068163160
Topological Polar Surface Area	32.8 Å²
Heavy Atom Count	5
Formal Charge	0
Complexity	35.9
Isotope Atom Count	5
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes