2-[2-[2-(2-hydroxypropoxy)propoxy]propoxy]propyl prop-2-enoate

C15H28O6 — CID 21458421

IUPAC2-[2-[2-(2-hydroxypropoxy)propoxy]propoxy]propyl prop-2-enoate
SMILESC=CC(=O)OCC(C)OCC(C)OCC(C)OCC(C)O
InChIInChI=1S/C15H28O6/c1-6-15(17)21-10-14(5)20-9-13(4)19-8-12(3)18-7-11(2)16/h6,11-14,16H,1,7-10H2,2-5H3
InChIKeyAIVLDPZRYJCEPU-UHFFFAOYSA-N
MW304.38 g/mol
LogP1.31
Rot. Bonds12

About 2-[2-[2-(2-hydroxypropoxy)propoxy]propoxy]propyl prop-2-enoate

2-[2-[2-(2-hydroxypropoxy)propoxy]propoxy]propyl prop-2-enoate (PubChem CID 21458421) has the molecular formula C15H28O6 and a molecular weight of 304.38 g/mol. Its IUPAC name is 2-[2-[2-(2-hydroxypropoxy)propoxy]propoxy]propyl prop-2-enoate.

Molecular Properties

Compound Name2-[2-[2-(2-hydroxypropoxy)propoxy]propoxy]propyl prop-2-enoate
PubChem CID21458421
Molecular FormulaC15H28O6
Molecular Weight304.38 g/mol
Exact Mass304.19
IUPAC Name2-[2-[2-(2-hydroxypropoxy)propoxy]propoxy]propyl prop-2-enoate
SMILESC=CC(=O)OCC(C)OCC(C)OCC(C)OCC(C)O
InChIInChI=1S/C15H28O6/c1-6-15(17)21-10-14(5)20-9-13(4)19-8-12(3)18-7-11(2)16/h6,11-14,16H,1,7-10H2,2-5H3
InChIKeyAIVLDPZRYJCEPU-UHFFFAOYSA-N
XLogP1.31
TPSA74.22 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds12
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.38
LogP ≤ 51.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Related Compounds

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-[2,3-bis(1-prop-2-enoyloxypropan-2-yloxy)propoxy]propyl prop-2-enoate
CID 138059610
2-[2-(2-hydroxypropoxy)propoxy]propan-1-ol;methyl prop-2-enoate
CID 162118566
2-[2-(2-hydroxypropoxy)propoxy]propan-1-ol;bis(prop-2-enamide)
CID 174995631
2-hydroxypropyl 2-methyl-3-prop-2-enoyloxypropanoate
CID 151533065
1-O-[1-(1-prop-2-enoxypropan-2-yloxy)propan-2-yl] 2-O-[1-(1-prop-2-enoyloxypropan-2-yloxy)propan-2-yl] oxalate
CID 146180705
2-[2-[2-[2-(2-hydroxypropoxy)propoxy]propoxy]propoxy]propan-1-ol;prop-2-enoic acid
CID 87252519
2-[2-(2-hydroxypropoxy)propoxy]propyl acetate
CID 87518170
2-[1-(1-methoxypropan-2-yloxy)propan-2-yloxy]ethyl prop-2-enoate
CID 135130322
methane;2-prop-2-enoyloxypropyl prop-2-enoate
CID 161351901
2-[2-(2-hydroxypropoxy)propoxy]propan-1-ol;methyl prop-2-enoate;phosphoric acid
CID 172679706

Frequently Asked Questions

What is the IUPAC name of 2-[2-[2-(2-hydroxypropoxy)propoxy]propoxy]propyl prop-2-enoate?
The IUPAC name of 2-[2-[2-(2-hydroxypropoxy)propoxy]propoxy]propyl prop-2-enoate (CID 21458421) is 2-[2-[2-(2-hydroxypropoxy)propoxy]propoxy]propyl prop-2-enoate.
What is the SMILES notation for 2-[2-[2-(2-hydroxypropoxy)propoxy]propoxy]propyl prop-2-enoate?
The canonical SMILES for 2-[2-[2-(2-hydroxypropoxy)propoxy]propoxy]propyl prop-2-enoate is C=CC(=O)OCC(C)OCC(C)OCC(C)OCC(C)O.
What is the InChIKey of 2-[2-[2-(2-hydroxypropoxy)propoxy]propoxy]propyl prop-2-enoate?
The InChIKey is AIVLDPZRYJCEPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28O6/c1-6-15(17)21-10-14(5)20-9-13(4)19-8-12(3)18-7-11(2)16/h6,11-14,16H,1,7-10H2,2-5H3.
What are the key properties of 2-[2-[2-(2-hydroxypropoxy)propoxy]propoxy]propyl prop-2-enoate?
2-[2-[2-(2-hydroxypropoxy)propoxy]propoxy]propyl prop-2-enoate has a molecular weight of 304.38 g/mol, XLogP of 1.31, 12 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[2-(2-hydroxypropoxy)propoxy]propoxy]propyl prop-2-enoate is sourced from PubChem (CID 21458421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).