Succinic acid-2,2,3,3-d4
C₄H₆O₄·122.110 g/mol·CID 12998487
IUPAC: 2,2,3,3-tetradeuteriobutanedioic acid
Also known as: RefChem:889416, 664-303-5, 14493-42-6, Succinic-d4 acid, succinic acid-d4 (+14 more)
Molecular Structure
Molecular Propertiesmass · H-bonds · stereo
Molecular Weight
122.110g/mol
Exact Mass
122.051716Da
Monoisotopic Mass
122.051716Da
XLogP
-0.6
Polar Surface Area
74.6Ų
Complexity
92
Formal Charge
0
H-Bond Donors
2
H-Bond Acceptors
4
Rotatable Bonds
3
Heavy Atoms
8
Stereo Centers
0
Bond Stereo
0
Drug-Likeness (Lipinski's Rule of Five)
✓ 122.1 g/mol
MW ≤ 500
✓ -0.6
LogP ≤ 5
✓ 2
H-bond donors ≤ 5
✓ 4
H-bond acceptors ≤ 10
Passes all rules — good oral bioavailability predicted
GHS Hazard Classification
Danger
Hazards
H315Causes skin irritationH318Causes serious eye damageH335May cause respiratory irritation
Source: PubChem GHS Classification. Always consult the SDS for handling.
Chemical IdentifiersSMILES · InChI
InChI
InChI=1S/C4H6O4/c5-3(6)1-2-4(7)8/h1-2H2,(H,5,6)(H,7,8)/i1D2,2D2
Isomers8 compounds with formula C₄H₆O₄
butanedioic acid
CID 1110 · 118.1 g/mol
2-methylpropanedioic acid
CID 487 · 118.1 g/mol
2-formyloxyethyl formate
CID 12376 · 118.1 g/mol
dimethyl oxalate
CID 11120 · 118.1 g/mol
acetyl ethaneperoxoate
CID 8040 · 118.1 g/mol
4-(hydroxymethyl)-1,3-dioxolan-2-one
CID 97944 · 118.1 g/mol
2-acetyloxyacetic acid
CID 83766 · 118.1 g/mol
(3R,4R)-3,4-dihydroxyoxolan-2-one
CID 5325915 · 118.1 g/mol