2-[2-[2-(2-hydroxypropanoyloxy)propoxy]propoxy]propyl 2-hydroxypropanoate

C15H28O8 — CID 87122386

IUPAC2-[2-[2-(2-hydroxypropanoyloxy)propoxy]propoxy]propyl 2-hydroxypropanoate
SMILESCC(COC(=O)C(C)O)OCC(C)OCC(C)OC(=O)C(C)O
InChIInChI=1S/C15H28O8/c1-9(21-8-11(3)23-15(19)13(5)17)6-20-10(2)7-22-14(18)12(4)16/h9-13,16-17H,6-8H2,1-5H3
InChIKeyAVNAGUVUUDPPJP-UHFFFAOYSA-N
MW336.38 g/mol
LogP0.03
Rot. Bonds11

About 2-[2-[2-(2-hydroxypropanoyloxy)propoxy]propoxy]propyl 2-hydroxypropanoate

2-[2-[2-(2-hydroxypropanoyloxy)propoxy]propoxy]propyl 2-hydroxypropanoate (PubChem CID 87122386) has the molecular formula C15H28O8 and a molecular weight of 336.38 g/mol. Its IUPAC name is 2-[2-[2-(2-hydroxypropanoyloxy)propoxy]propoxy]propyl 2-hydroxypropanoate.

Molecular Properties

Compound Name2-[2-[2-(2-hydroxypropanoyloxy)propoxy]propoxy]propyl 2-hydroxypropanoate
PubChem CID87122386
Molecular FormulaC15H28O8
Molecular Weight336.38 g/mol
Exact Mass336.18
IUPAC Name2-[2-[2-(2-hydroxypropanoyloxy)propoxy]propoxy]propyl 2-hydroxypropanoate
SMILESCC(COC(=O)C(C)O)OCC(C)OCC(C)OC(=O)C(C)O
InChIInChI=1S/C15H28O8/c1-9(21-8-11(3)23-15(19)13(5)17)6-20-10(2)7-22-14(18)12(4)16/h9-13,16-17H,6-8H2,1-5H3
InChIKeyAVNAGUVUUDPPJP-UHFFFAOYSA-N
XLogP0.03
TPSA111.52 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds11
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.38
LogP ≤ 50.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

Analyze 2-[2-[2-(2-hydroxypropanoyloxy)propoxy]propoxy]propyl 2-hydroxypropanoate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[2-[(2R)-2-hydroxypropanoyl]oxy-3-[(2S)-2-hydroxypropanoyl]oxypropyl] (2S)-2-hydroxypropanoate
CID 76972802
[(2R)-1-hydroxypropan-2-yl] (2S)-2-hydroxypropanoate
CID 167060953
2-(2-hydroxybutanoyloxy)propyl 2-hydroxybutanoate
CID 122574253
2-[2-(2-hydroxypropoxy)propoxy]propyl acetate
CID 87518170
2-[2-[2-(2-chloroacetyl)oxypropoxy]propoxy]propyl 2-chloroacetate
CID 118067128
2-[2-[2-[2-[2-(2-hydroxypropoxy)propoxy]propoxy]propoxy]propoxy]propyl 2-methylbutanoate
CID 58444916
2-[2-[2-[2-[2-[2-[2-[2-(2-methylprop-2-enoyloxy)propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propyl 2-methylprop-2-enoate
CID 18762108
2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-prop-2-enoyloxypropoxy)propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propyl prop-2-enoate
CID 139889526
2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-prop-2-enoyloxypropoxy)propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propyl prop-2-enoate
CID 121420632
2-[2-(2-butanoyloxypropoxy)propoxy]propyl butanoate
CID 139914306
2-[2-[2-(3-sulfanylbutanoyloxy)propoxy]propoxy]propyl 3-sulfanylbutanoate
CID 87066127
2-(2-butanoyloxypropoxy)propyl butanoate
CID 91036276

Frequently Asked Questions

What is the IUPAC name of 2-[2-[2-(2-hydroxypropanoyloxy)propoxy]propoxy]propyl 2-hydroxypropanoate?
The IUPAC name of 2-[2-[2-(2-hydroxypropanoyloxy)propoxy]propoxy]propyl 2-hydroxypropanoate (CID 87122386) is 2-[2-[2-(2-hydroxypropanoyloxy)propoxy]propoxy]propyl 2-hydroxypropanoate.
What is the SMILES notation for 2-[2-[2-(2-hydroxypropanoyloxy)propoxy]propoxy]propyl 2-hydroxypropanoate?
The canonical SMILES for 2-[2-[2-(2-hydroxypropanoyloxy)propoxy]propoxy]propyl 2-hydroxypropanoate is CC(COC(=O)C(C)O)OCC(C)OCC(C)OC(=O)C(C)O.
What is the InChIKey of 2-[2-[2-(2-hydroxypropanoyloxy)propoxy]propoxy]propyl 2-hydroxypropanoate?
The InChIKey is AVNAGUVUUDPPJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28O8/c1-9(21-8-11(3)23-15(19)13(5)17)6-20-10(2)7-22-14(18)12(4)16/h9-13,16-17H,6-8H2,1-5H3.
What are the key properties of 2-[2-[2-(2-hydroxypropanoyloxy)propoxy]propoxy]propyl 2-hydroxypropanoate?
2-[2-[2-(2-hydroxypropanoyloxy)propoxy]propoxy]propyl 2-hydroxypropanoate has a molecular weight of 336.38 g/mol, XLogP of 0.03, 11 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[2-(2-hydroxypropanoyloxy)propoxy]propoxy]propyl 2-hydroxypropanoate is sourced from PubChem (CID 87122386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).