methyl (2R)-2-(2-butoxyethoxy)propanoate

C10H20O4 — CID 103337806

IUPACmethyl (2R)-2-(2-butoxyethoxy)propanoate
SMILESCCCCOCCO[C@H](C)C(=O)OC
InChIInChI=1S/C10H20O4/c1-4-5-6-13-7-8-14-9(2)10(11)12-3/h9H,4-8H2,1-3H3/t9-/m1/s1
InChIKeyGYHKDGZZSJKGQC-SECBINFHSA-N
MW204.27 g/mol
LogP1.38
Rot. Bonds8

About methyl (2R)-2-(2-butoxyethoxy)propanoate

methyl (2R)-2-(2-butoxyethoxy)propanoate (PubChem CID 103337806) has the molecular formula C10H20O4 and a molecular weight of 204.27 g/mol. Its IUPAC name is methyl (2R)-2-(2-butoxyethoxy)propanoate.

Molecular Properties

Compound Namemethyl (2R)-2-(2-butoxyethoxy)propanoate
PubChem CID103337806
Molecular FormulaC10H20O4
Molecular Weight204.27 g/mol
Exact Mass204.14
IUPAC Namemethyl (2R)-2-(2-butoxyethoxy)propanoate
SMILESCCCCOCCO[C@H](C)C(=O)OC
InChIInChI=1S/C10H20O4/c1-4-5-6-13-7-8-14-9(2)10(11)12-3/h9H,4-8H2,1-3H3/t9-/m1/s1
InChIKeyGYHKDGZZSJKGQC-SECBINFHSA-N
XLogP1.38
TPSA44.76 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.27
LogP ≤ 51.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

methyl 2-(2-ethoxyethoxy)propanoate
CID 61234478
3-(2-butoxyethoxy)butan-2-one
CID 43800225
methyl (2S)-2-hexoxypropanoate
CID 103337819
methyl 2-dodecoxypropanoate
CID 86244254
tert-butyl 2-(2-butoxyethoxy)propanoate
CID 66337185
2-[2-[2-(2-butoxyethoxy)ethoxy]ethoxy]propanethioamide
CID 104561989
methyl 2-[2-[2-(2-butoxyethoxy)ethoxy]ethylamino]propanoate
CID 104561977
2-[2-(3-methoxypropoxy)ethoxy]propanamide
CID 103179570
methyl (2R)-3-butoxy-2-methylpropanoate
CID 88918019
methyl 2-(2-hydroxyethoxy)propanoate
CID 15099863
2-(2-butoxyethoxy)-1-(4-chlorophenyl)propan-1-one
CID 43800190
N-(4-amino-2-chlorophenyl)-2-(2-butoxyethoxy)propanamide
CID 43127117

Frequently Asked Questions

What is the IUPAC name of methyl (2R)-2-(2-butoxyethoxy)propanoate?
The IUPAC name of methyl (2R)-2-(2-butoxyethoxy)propanoate (CID 103337806) is methyl (2R)-2-(2-butoxyethoxy)propanoate.
What is the SMILES notation for methyl (2R)-2-(2-butoxyethoxy)propanoate?
The canonical SMILES for methyl (2R)-2-(2-butoxyethoxy)propanoate is CCCCOCCO[C@H](C)C(=O)OC.
What is the InChIKey of methyl (2R)-2-(2-butoxyethoxy)propanoate?
The InChIKey is GYHKDGZZSJKGQC-SECBINFHSA-N. The full InChI is InChI=1S/C10H20O4/c1-4-5-6-13-7-8-14-9(2)10(11)12-3/h9H,4-8H2,1-3H3/t9-/m1/s1.
What are the key properties of methyl (2R)-2-(2-butoxyethoxy)propanoate?
methyl (2R)-2-(2-butoxyethoxy)propanoate has a molecular weight of 204.27 g/mol, XLogP of 1.38, 8 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl (2R)-2-(2-butoxyethoxy)propanoate is sourced from PubChem (CID 103337806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).