ethoxyethane;ethyl acetate;2-[2-(2-hydroxypropoxy)propoxy]propan-1-ol

C17H38O7 — CID 87173315

IUPACethoxyethane;ethyl acetate;2-[2-(2-hydroxypropoxy)propoxy]propan-1-ol
SMILESCC(O)COC(C)COC(C)CO.CCOC(C)=O.CCOCC
InChIInChI=1S/C9H20O4.C4H8O2.C4H10O/c1-7(11)5-12-9(3)6-13-8(2)4-10;1-3-6-4(2)5;1-3-5-4-2/h7-11H,4-6H2,1-3H3;3H2,1-2H3;3-4H2,1-2H3
InChIKeyFPZMQRSPJJEICJ-UHFFFAOYSA-N
MW354.48 g/mol
LogP1.78
Rot. Bonds10

About ethoxyethane;ethyl acetate;2-[2-(2-hydroxypropoxy)propoxy]propan-1-ol

ethoxyethane;ethyl acetate;2-[2-(2-hydroxypropoxy)propoxy]propan-1-ol (PubChem CID 87173315) has the molecular formula C17H38O7 and a molecular weight of 354.48 g/mol. Its IUPAC name is ethoxyethane;ethyl acetate;2-[2-(2-hydroxypropoxy)propoxy]propan-1-ol.

Molecular Properties

Compound Nameethoxyethane;ethyl acetate;2-[2-(2-hydroxypropoxy)propoxy]propan-1-ol
PubChem CID87173315
Molecular FormulaC17H38O7
Molecular Weight354.48 g/mol
Exact Mass354.26
IUPAC Nameethoxyethane;ethyl acetate;2-[2-(2-hydroxypropoxy)propoxy]propan-1-ol
SMILESCC(O)COC(C)COC(C)CO.CCOC(C)=O.CCOCC
InChIInChI=1S/C9H20O4.C4H8O2.C4H10O/c1-7(11)5-12-9(3)6-13-8(2)4-10;1-3-6-4(2)5;1-3-5-4-2/h7-11H,4-6H2,1-3H3;3H2,1-2H3;3-4H2,1-2H3
InChIKeyFPZMQRSPJJEICJ-UHFFFAOYSA-N
XLogP1.78
TPSA94.45 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds10
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.48
LogP ≤ 51.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

2-(2-ethoxypropoxy)propyl acetate;2-(2-hydroxypropoxy)propan-1-ol
CID 158412024
2-(2-ethoxyethoxy)ethyl acetate;2-(2-hydroxypropoxy)propan-1-ol
CID 162146312
1-ethoxypropan-2-ol;2-[2-(2-hydroxypropoxy)propoxy]propan-1-ol
CID 161457243
1-ethoxy-2-(2-ethoxypropoxy)propane;2-(2-hydroxypropoxy)propan-1-ol
CID 157472623
2-[2-(2-hydroxypropoxy)propoxy]propyl acetate
CID 87518170
2-(2-hydroxypropoxy)propan-1-ol;propan-2-one
CID 21325277
(2R)-2-[(2R)-2-[(2R)-2-[(2R)-2-[(2S)-2-[(2R)-2-hydroxypropoxy]propoxy]propoxy]propoxy]propoxy]propan-1-ol
CID 135398128
2-[(2S)-2-(2-hydroxypropoxy)propoxy]propan-1-ol
CID 57250995
2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxypropoxy)propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propan-1-ol
CID 129258007
2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxypropoxy)propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propan-1-ol
CID 22051694
(2R)-2-[(2R)-2-[(2R)-2-[(2R)-2-[(2R)-2-[(2S)-2-[(2R)-2-hydroxypropoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propan-1-ol
CID 52944184
2-ethoxypropane;2-[2-(2-hydroxypropoxy)propoxy]propan-1-ol
CID 134346005

Frequently Asked Questions

What is the IUPAC name of ethoxyethane;ethyl acetate;2-[2-(2-hydroxypropoxy)propoxy]propan-1-ol?
The IUPAC name of ethoxyethane;ethyl acetate;2-[2-(2-hydroxypropoxy)propoxy]propan-1-ol (CID 87173315) is ethoxyethane;ethyl acetate;2-[2-(2-hydroxypropoxy)propoxy]propan-1-ol.
What is the SMILES notation for ethoxyethane;ethyl acetate;2-[2-(2-hydroxypropoxy)propoxy]propan-1-ol?
The canonical SMILES for ethoxyethane;ethyl acetate;2-[2-(2-hydroxypropoxy)propoxy]propan-1-ol is CC(O)COC(C)COC(C)CO.CCOC(C)=O.CCOCC.
What is the InChIKey of ethoxyethane;ethyl acetate;2-[2-(2-hydroxypropoxy)propoxy]propan-1-ol?
The InChIKey is FPZMQRSPJJEICJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20O4.C4H8O2.C4H10O/c1-7(11)5-12-9(3)6-13-8(2)4-10;1-3-6-4(2)5;1-3-5-4-2/h7-11H,4-6H2,1-3H3;3H2,1-2H3;3-4H2,1-2H3.
What are the key properties of ethoxyethane;ethyl acetate;2-[2-(2-hydroxypropoxy)propoxy]propan-1-ol?
ethoxyethane;ethyl acetate;2-[2-(2-hydroxypropoxy)propoxy]propan-1-ol has a molecular weight of 354.48 g/mol, XLogP of 1.78, 10 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for ethoxyethane;ethyl acetate;2-[2-(2-hydroxypropoxy)propoxy]propan-1-ol is sourced from PubChem (CID 87173315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).