3-aminopropyl hypofluorite

C3H8FNO — CID 59085993

IUPAC3-aminopropyl hypofluorite
SMILESNCCCOF
InChIInChI=1S/C3H8FNO/c4-6-3-1-2-5/h1-3,5H2
InChIKeyYXANHOBCRGZMBW-UHFFFAOYSA-N
MW93.10 g/mol
LogP0.24
Rot. Bonds3

About 3-aminopropyl hypofluorite

3-aminopropyl hypofluorite (PubChem CID 59085993) has the molecular formula C3H8FNO and a molecular weight of 93.10 g/mol. Its IUPAC name is 3-aminopropyl hypofluorite.

Molecular Properties

Compound Name3-aminopropyl hypofluorite
PubChem CID59085993
Molecular FormulaC3H8FNO
Molecular Weight93.10 g/mol
Exact Mass93.06
IUPAC Name3-aminopropyl hypofluorite
SMILESNCCCOF
InChIInChI=1S/C3H8FNO/c4-6-3-1-2-5/h1-3,5H2
InChIKeyYXANHOBCRGZMBW-UHFFFAOYSA-N
XLogP0.24
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50093.10
LogP ≤ 50.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-Aminooxy-3-aminopropane
CID 65020
O-(3-Amino-2-fluoro-propyl)-hydroxylamine
CID 126497
3-Azaniumyloxypropylazanium
CID 24916920
Propylamine, 3-(2'-fluoroethoxy)-
CID 68969
Aminopropoxysilane
CID 60077004
1-Aminopropyl hypofluorite
CID 57256793
3-(3-Fluoropropoxy)propan-1-amine
CID 58684358
N-fluoro-3-methoxypropan-1-amine
CID 59335539
2-Fluoro-3-methoxypropan-1-amine
CID 83853881
(2R)-2-fluoro-3-methoxypropan-1-amine
CID 90155166
(2S)-2-fluoro-3-methoxypropan-1-amine
CID 124547450
1-Fluoro-3-methoxypropan-1-amine
CID 151122327

Frequently Asked Questions

What is the IUPAC name of 3-aminopropyl hypofluorite?
The IUPAC name of 3-aminopropyl hypofluorite (CID 59085993) is 3-aminopropyl hypofluorite.
What is the SMILES notation for 3-aminopropyl hypofluorite?
The canonical SMILES for 3-aminopropyl hypofluorite is NCCCOF.
What is the InChIKey of 3-aminopropyl hypofluorite?
The InChIKey is YXANHOBCRGZMBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H8FNO/c4-6-3-1-2-5/h1-3,5H2.
What are the key properties of 3-aminopropyl hypofluorite?
3-aminopropyl hypofluorite has a molecular weight of 93.10 g/mol, XLogP of 0.24, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-aminopropyl hypofluorite is sourced from PubChem (CID 59085993), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).