fluorophosphonic acid;prop-2-en-1-amine

C3H9FNO3P — CID 173413969

IUPACfluorophosphonic acid;prop-2-en-1-amine
SMILESC=CCN.O=P(O)(O)F
InChIInChI=1S/C3H7N.FH2O3P/c1-2-3-4;1-5(2,3)4/h2H,1,3-4H2;(H2,2,3,4)
InChIKeyUKMPHPDYYSCBEB-UHFFFAOYSA-N
MW157.08 g/mol
LogP0.18
Rot. Bonds1

About fluorophosphonic acid;prop-2-en-1-amine

fluorophosphonic acid;prop-2-en-1-amine (PubChem CID 173413969) has the molecular formula C3H9FNO3P and a molecular weight of 157.08 g/mol. Its IUPAC name is fluorophosphonic acid;prop-2-en-1-amine.

Molecular Properties

Compound Namefluorophosphonic acid;prop-2-en-1-amine
PubChem CID173413969
Molecular FormulaC3H9FNO3P
Molecular Weight157.08 g/mol
Exact Mass157.03
IUPAC Namefluorophosphonic acid;prop-2-en-1-amine
SMILESC=CCN.O=P(O)(O)F
InChIInChI=1S/C3H7N.FH2O3P/c1-2-3-4;1-5(2,3)4/h2H,1,3-4H2;(H2,2,3,4)
InChIKeyUKMPHPDYYSCBEB-UHFFFAOYSA-N
XLogP0.18
TPSA83.55 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.08
LogP ≤ 50.18
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

prop-2-en-1-amine;bis(trihydroxy(sulfanylidene)-λ5-phosphane)
CID 87783946
fluoromethane;prop-2-en-1-amine
CID 173426164
ethane-1,2-diol;prop-2-en-1-amine
CID 87098276
prop-2-en-1-amine;zinc;hydrochloride
CID 174943881
azane;prop-2-en-1-amine;hydrochloride
CID 174769077
CID 174370439
CID 174370439
ethenone;prop-2-en-1-amine
CID 173182769
fluorophosphonic acid;zinc
CID 173113621
fluorophosphonic acid;dihydroiodide
CID 172705626
copper;fluorophosphonic acid
CID 173104152
alumane;fluorophosphonic acid
CID 173163644
cyclohexane;bis(prop-2-en-1-amine)
CID 67816454

Frequently Asked Questions

What is the IUPAC name of fluorophosphonic acid;prop-2-en-1-amine?
The IUPAC name of fluorophosphonic acid;prop-2-en-1-amine (CID 173413969) is fluorophosphonic acid;prop-2-en-1-amine.
What is the SMILES notation for fluorophosphonic acid;prop-2-en-1-amine?
The canonical SMILES for fluorophosphonic acid;prop-2-en-1-amine is C=CCN.O=P(O)(O)F.
What is the InChIKey of fluorophosphonic acid;prop-2-en-1-amine?
The InChIKey is UKMPHPDYYSCBEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H7N.FH2O3P/c1-2-3-4;1-5(2,3)4/h2H,1,3-4H2;(H2,2,3,4).
What are the key properties of fluorophosphonic acid;prop-2-en-1-amine?
fluorophosphonic acid;prop-2-en-1-amine has a molecular weight of 157.08 g/mol, XLogP of 0.18, 1 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for fluorophosphonic acid;prop-2-en-1-amine is sourced from PubChem (CID 173413969), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).