2-(2-ethoxypropoxy)propyl acetate;2-(2-hydroxypropoxy)propan-1-ol

C16H34O7 — CID 158412024

IUPAC2-(2-ethoxypropoxy)propyl acetate;2-(2-hydroxypropoxy)propan-1-ol
SMILESCC(O)COC(C)CO.CCOC(C)COC(C)COC(C)=O
InChIInChI=1S/C10H20O4.C6H14O3/c1-5-12-8(2)6-13-9(3)7-14-10(4)11;1-5(8)4-9-6(2)3-7/h8-9H,5-7H2,1-4H3;5-8H,3-4H2,1-2H3
InChIKeyGZKVJZLUUUHZQS-UHFFFAOYSA-N
MW338.44 g/mol
LogP1.14
Rot. Bonds11

About 2-(2-ethoxypropoxy)propyl acetate;2-(2-hydroxypropoxy)propan-1-ol

2-(2-ethoxypropoxy)propyl acetate;2-(2-hydroxypropoxy)propan-1-ol (PubChem CID 158412024) has the molecular formula C16H34O7 and a molecular weight of 338.44 g/mol. Its IUPAC name is 2-(2-ethoxypropoxy)propyl acetate;2-(2-hydroxypropoxy)propan-1-ol.

Molecular Properties

Compound Name2-(2-ethoxypropoxy)propyl acetate;2-(2-hydroxypropoxy)propan-1-ol
PubChem CID158412024
Molecular FormulaC16H34O7
Molecular Weight338.44 g/mol
Exact Mass338.23
IUPAC Name2-(2-ethoxypropoxy)propyl acetate;2-(2-hydroxypropoxy)propan-1-ol
SMILESCC(O)COC(C)CO.CCOC(C)COC(C)COC(C)=O
InChIInChI=1S/C10H20O4.C6H14O3/c1-5-12-8(2)6-13-9(3)7-14-10(4)11;1-5(8)4-9-6(2)3-7/h8-9H,5-7H2,1-4H3;5-8H,3-4H2,1-2H3
InChIKeyGZKVJZLUUUHZQS-UHFFFAOYSA-N
XLogP1.14
TPSA94.45 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds11
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.44
LogP ≤ 51.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

ethoxyethane;ethyl acetate;2-[2-(2-hydroxypropoxy)propoxy]propan-1-ol
CID 87173315
2-[2-(2-hydroxypropoxy)propoxy]propyl acetate
CID 87518170
1-ethoxy-2-(2-ethoxypropoxy)propane;2-(2-hydroxypropoxy)propan-1-ol
CID 157472623
2-ethoxypropane;2-[2-(2-hydroxypropoxy)propoxy]propan-1-ol
CID 134346005
2-(2-hydroxypropoxy)propan-1-ol;propan-2-one
CID 21325277
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
2-[(2S)-2-(2-hydroxypropoxy)propoxy]propan-1-ol
CID 57250995
(2R)-2-[(2R)-2-[(2R)-2-[(2R)-2-[(2S)-2-[(2R)-2-hydroxypropoxy]propoxy]propoxy]propoxy]propoxy]propan-1-ol
CID 135398128
(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-(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

Frequently Asked Questions

What is the IUPAC name of 2-(2-ethoxypropoxy)propyl acetate;2-(2-hydroxypropoxy)propan-1-ol?
The IUPAC name of 2-(2-ethoxypropoxy)propyl acetate;2-(2-hydroxypropoxy)propan-1-ol (CID 158412024) is 2-(2-ethoxypropoxy)propyl acetate;2-(2-hydroxypropoxy)propan-1-ol.
What is the SMILES notation for 2-(2-ethoxypropoxy)propyl acetate;2-(2-hydroxypropoxy)propan-1-ol?
The canonical SMILES for 2-(2-ethoxypropoxy)propyl acetate;2-(2-hydroxypropoxy)propan-1-ol is CC(O)COC(C)CO.CCOC(C)COC(C)COC(C)=O.
What is the InChIKey of 2-(2-ethoxypropoxy)propyl acetate;2-(2-hydroxypropoxy)propan-1-ol?
The InChIKey is GZKVJZLUUUHZQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20O4.C6H14O3/c1-5-12-8(2)6-13-9(3)7-14-10(4)11;1-5(8)4-9-6(2)3-7/h8-9H,5-7H2,1-4H3;5-8H,3-4H2,1-2H3.
What are the key properties of 2-(2-ethoxypropoxy)propyl acetate;2-(2-hydroxypropoxy)propan-1-ol?
2-(2-ethoxypropoxy)propyl acetate;2-(2-hydroxypropoxy)propan-1-ol has a molecular weight of 338.44 g/mol, XLogP of 1.14, 11 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethoxypropoxy)propyl acetate;2-(2-hydroxypropoxy)propan-1-ol is sourced from PubChem (CID 158412024), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).