2-(2-hydroxypropanoyloxy)acetic acid;2-oxopropyl 2-hydroxypropanoate

C11H18O9 — CID 160871325

IUPAC2-(2-hydroxypropanoyloxy)acetic acid;2-oxopropyl 2-hydroxypropanoate
SMILESCC(=O)COC(=O)C(C)O.CC(O)C(=O)OCC(=O)O
InChIInChI=1S/C6H10O4.C5H8O5/c1-4(7)3-10-6(9)5(2)8;1-3(6)5(9)10-2-4(7)8/h5,8H,3H2,1-2H3;3,6H,2H2,1H3,(H,7,8)
InChIKeySLUKDYZOIQLIEK-UHFFFAOYSA-N
MW294.26 g/mol
LogP-1.51
Rot. Bonds6

About 2-(2-hydroxypropanoyloxy)acetic acid;2-oxopropyl 2-hydroxypropanoate

2-(2-hydroxypropanoyloxy)acetic acid;2-oxopropyl 2-hydroxypropanoate (PubChem CID 160871325) has the molecular formula C11H18O9 and a molecular weight of 294.26 g/mol. Its IUPAC name is 2-(2-hydroxypropanoyloxy)acetic acid;2-oxopropyl 2-hydroxypropanoate.

Molecular Properties

Compound Name2-(2-hydroxypropanoyloxy)acetic acid;2-oxopropyl 2-hydroxypropanoate
PubChem CID160871325
Molecular FormulaC11H18O9
Molecular Weight294.26 g/mol
Exact Mass294.10
IUPAC Name2-(2-hydroxypropanoyloxy)acetic acid;2-oxopropyl 2-hydroxypropanoate
SMILESCC(=O)COC(=O)C(C)O.CC(O)C(=O)OCC(=O)O
InChIInChI=1S/C6H10O4.C5H8O5/c1-4(7)3-10-6(9)5(2)8;1-3(6)5(9)10-2-4(7)8/h5,8H,3H2,1-2H3;3,6H,2H2,1H3,(H,7,8)
InChIKeySLUKDYZOIQLIEK-UHFFFAOYSA-N
XLogP-1.51
TPSA147.43 Ų
H-Bond Donors3
H-Bond Acceptors8
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.26
LogP ≤ 5-1.51
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 108

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Related Compounds

2-[2-(2-hydroxypropanoyloxy)acetyl]oxyacetic acid
CID 59117352
(2-methoxy-2-oxoethyl) 2-hydroxypropanoate
CID 19788816
butan-2-one;ethyl 2-hydroxypropanoate
CID 19875658
4-[2-(2-hydroxypropanoyloxy)acetyl]oxybutanoic acid
CID 175389566
bis(2-acetyloxyacetic acid);palladium
CID 156697217
acetic acid;2-hydroxyacetic acid;propyl 2-hydroxypropanoate
CID 175389554
ethyl 2-hydroxypropanoate;2-fluoroacetic acid
CID 174849871
3,3-dimethylbutan-2-one;2-(2-methoxypropanoyloxy)acetic acid
CID 162206805
ethyl 2-hydroxypropanoate;sulfane
CID 162209332
[2-[(2R)-2-hydroxypropanoyl]oxy-3-[(2S)-2-hydroxypropanoyl]oxypropyl] (2S)-2-hydroxypropanoate
CID 76972802
2-oxopropyl acetate;bis(vanadium)
CID 175077929
methanol;2-oxopropyl acetate
CID 174729097

Frequently Asked Questions

What is the IUPAC name of 2-(2-hydroxypropanoyloxy)acetic acid;2-oxopropyl 2-hydroxypropanoate?
The IUPAC name of 2-(2-hydroxypropanoyloxy)acetic acid;2-oxopropyl 2-hydroxypropanoate (CID 160871325) is 2-(2-hydroxypropanoyloxy)acetic acid;2-oxopropyl 2-hydroxypropanoate.
What is the SMILES notation for 2-(2-hydroxypropanoyloxy)acetic acid;2-oxopropyl 2-hydroxypropanoate?
The canonical SMILES for 2-(2-hydroxypropanoyloxy)acetic acid;2-oxopropyl 2-hydroxypropanoate is CC(=O)COC(=O)C(C)O.CC(O)C(=O)OCC(=O)O.
What is the InChIKey of 2-(2-hydroxypropanoyloxy)acetic acid;2-oxopropyl 2-hydroxypropanoate?
The InChIKey is SLUKDYZOIQLIEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10O4.C5H8O5/c1-4(7)3-10-6(9)5(2)8;1-3(6)5(9)10-2-4(7)8/h5,8H,3H2,1-2H3;3,6H,2H2,1H3,(H,7,8).
What are the key properties of 2-(2-hydroxypropanoyloxy)acetic acid;2-oxopropyl 2-hydroxypropanoate?
2-(2-hydroxypropanoyloxy)acetic acid;2-oxopropyl 2-hydroxypropanoate has a molecular weight of 294.26 g/mol, XLogP of -1.51, 6 rotatable bonds, 3 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-hydroxypropanoyloxy)acetic acid;2-oxopropyl 2-hydroxypropanoate is sourced from PubChem (CID 160871325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).