10-fluoroundec-10-enoic acid

C11H19FO2 — CID 10726803

IUPAC10-fluoroundec-10-enoic acid
SMILESC=C(F)CCCCCCCCC(=O)O
InChIInChI=1S/C11H19FO2/c1-10(12)8-6-4-2-3-5-7-9-11(13)14/h1-9H2,(H,13,14)
InChIKeyQLCMVEBZNUHMRZ-UHFFFAOYSA-N
MW202.27 g/mol
LogP3.67
Rot. Bonds9

About 10-fluoroundec-10-enoic acid

10-fluoroundec-10-enoic acid (PubChem CID 10726803) has the molecular formula C11H19FO2 and a molecular weight of 202.27 g/mol. Its IUPAC name is 10-fluoroundec-10-enoic acid.

Molecular Properties

Compound Name10-fluoroundec-10-enoic acid
PubChem CID10726803
Molecular FormulaC11H19FO2
Molecular Weight202.27 g/mol
Exact Mass202.14
IUPAC Name10-fluoroundec-10-enoic acid
SMILESC=C(F)CCCCCCCCC(=O)O
InChIInChI=1S/C11H19FO2/c1-10(12)8-6-4-2-3-5-7-9-11(13)14/h1-9H2,(H,13,14)
InChIKeyQLCMVEBZNUHMRZ-UHFFFAOYSA-N
XLogP3.67
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.27
LogP ≤ 53.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

Undecylenic Acid
CID 5634
9-Decenoic acid
CID 61743
11-Dodecenoic acid
CID 125207
8-Nonenoic Acid
CID 35860
22-Tricosenoic Acid
CID 543855
7-Octenoic acid
CID 543977
14-Pentadecenoic acid
CID 543854
3,4-Methylenesebacic acid
CID 124202122
12-Tridecenoic acid
CID 5282737
17-Octadecenoic acid
CID 5312444
7-oxo-11-Dodecenoic acid
CID 4374065
18-Fluorooleic acid
CID 5312955

Frequently Asked Questions

What is the IUPAC name of 10-fluoroundec-10-enoic acid?
The IUPAC name of 10-fluoroundec-10-enoic acid (CID 10726803) is 10-fluoroundec-10-enoic acid.
What is the SMILES notation for 10-fluoroundec-10-enoic acid?
The canonical SMILES for 10-fluoroundec-10-enoic acid is C=C(F)CCCCCCCCC(=O)O.
What is the InChIKey of 10-fluoroundec-10-enoic acid?
The InChIKey is QLCMVEBZNUHMRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19FO2/c1-10(12)8-6-4-2-3-5-7-9-11(13)14/h1-9H2,(H,13,14).
What are the key properties of 10-fluoroundec-10-enoic acid?
10-fluoroundec-10-enoic acid has a molecular weight of 202.27 g/mol, XLogP of 3.67, 9 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 10-fluoroundec-10-enoic acid is sourced from PubChem (CID 10726803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).