3-fluoro-2,3-dimethyl-5-propoxypent-1-ene

C10H19FO — CID 149472519

IUPAC3-fluoro-2,3-dimethyl-5-propoxypent-1-ene
SMILESC=C(C)C(C)(F)CCOCCC
InChIInChI=1S/C10H19FO/c1-5-7-12-8-6-10(4,11)9(2)3/h2,5-8H2,1,3-4H3
InChIKeyZBQDXNJVXCYASO-UHFFFAOYSA-N
MW174.26 g/mol
LogP3.11
Rot. Bonds6

About 3-fluoro-2,3-dimethyl-5-propoxypent-1-ene

3-fluoro-2,3-dimethyl-5-propoxypent-1-ene (PubChem CID 149472519) has the molecular formula C10H19FO and a molecular weight of 174.26 g/mol. Its IUPAC name is 3-fluoro-2,3-dimethyl-5-propoxypent-1-ene.

Molecular Properties

Compound Name3-fluoro-2,3-dimethyl-5-propoxypent-1-ene
PubChem CID149472519
Molecular FormulaC10H19FO
Molecular Weight174.26 g/mol
Exact Mass174.14
IUPAC Name3-fluoro-2,3-dimethyl-5-propoxypent-1-ene
SMILESC=C(C)C(C)(F)CCOCCC
InChIInChI=1S/C10H19FO/c1-5-7-12-8-6-10(4,11)9(2)3/h2,5-8H2,1,3-4H3
InChIKeyZBQDXNJVXCYASO-UHFFFAOYSA-N
XLogP3.11
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.26
LogP ≤ 53.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

3-Fluoro-4-prop-1-en-2-yloxane
CID 147939897
3-Fluoro-5-methoxy-2,3-dimethylpent-1-ene
CID 163626851
5-Ethoxy-4,4-difluoro-2-methylpent-1-ene
CID 163738849
2-(Fluoromethyl)-4-(methoxymethyl)-4-methylhex-1-ene
CID 144407134
3-Fluoro-2,3-dimethyl-5-(2,2,2-trifluoroethoxy)pent-1-ene
CID 162608292
5-Ethoxy-2-methylpent-1-ene
CID 54336059
5-Butoxy-2,4-dimethylpent-1-ene
CID 89205246
2-Methyl-5-propoxypent-1-ene
CID 91171527
2-Methyl-5-(4-methylpent-4-enoxy)pent-1-ene
CID 140351781
5-Methoxy-2,3,3-trimethylpent-1-ene;propane
CID 142089843
1-Pentene, 5-butoxy-2-methyl-
CID 55274018
5-Methoxy-2,3,3-trimethylpent-1-ene
CID 142089844

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-2,3-dimethyl-5-propoxypent-1-ene?
The IUPAC name of 3-fluoro-2,3-dimethyl-5-propoxypent-1-ene (CID 149472519) is 3-fluoro-2,3-dimethyl-5-propoxypent-1-ene.
What is the SMILES notation for 3-fluoro-2,3-dimethyl-5-propoxypent-1-ene?
The canonical SMILES for 3-fluoro-2,3-dimethyl-5-propoxypent-1-ene is C=C(C)C(C)(F)CCOCCC.
What is the InChIKey of 3-fluoro-2,3-dimethyl-5-propoxypent-1-ene?
The InChIKey is ZBQDXNJVXCYASO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19FO/c1-5-7-12-8-6-10(4,11)9(2)3/h2,5-8H2,1,3-4H3.
What are the key properties of 3-fluoro-2,3-dimethyl-5-propoxypent-1-ene?
3-fluoro-2,3-dimethyl-5-propoxypent-1-ene has a molecular weight of 174.26 g/mol, XLogP of 3.11, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-2,3-dimethyl-5-propoxypent-1-ene is sourced from PubChem (CID 149472519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).