decanoic acid;phosphorous acid

C10H23O5P — CID 158036968

IUPACdecanoic acid;phosphorous acid
SMILESCCCCCCCCCC(=O)O.OP(O)O
InChIInChI=1S/C10H20O2.H3O3P/c1-2-3-4-5-6-7-8-9-10(11)12;1-4(2)3/h2-9H2,1H3,(H,11,12);1-3H
InChIKeyFHWFZSYPBLJEFG-UHFFFAOYSA-N
MW254.26 g/mol
LogP2.40
Rot. Bonds8

About decanoic acid;phosphorous acid

decanoic acid;phosphorous acid (PubChem CID 158036968) has the molecular formula C10H23O5P and a molecular weight of 254.26 g/mol. Its IUPAC name is decanoic acid;phosphorous acid.

Molecular Properties

Compound Namedecanoic acid;phosphorous acid
PubChem CID158036968
Molecular FormulaC10H23O5P
Molecular Weight254.26 g/mol
Exact Mass254.13
IUPAC Namedecanoic acid;phosphorous acid
SMILESCCCCCCCCCC(=O)O.OP(O)O
InChIInChI=1S/C10H20O2.H3O3P/c1-2-3-4-5-6-7-8-9-10(11)12;1-4(2)3/h2-9H2,1H3,(H,11,12);1-3H
InChIKeyFHWFZSYPBLJEFG-UHFFFAOYSA-N
XLogP2.40
TPSA97.99 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.26
LogP ≤ 52.40
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

bis(decanoic acid);bis(octanoic acid)
CID 160578094
decanoic acid;bis(nonanoic acid)
CID 159376136
henicosane;tetracontanoic acid
CID 175935348
henicosane;tricosanoic acid
CID 175935357
decanoic acid;tetradecanoic acid
CID 87611521
decanoic acid;dodecanoic acid;hexadecanoic acid;octanoic acid;tetradecanoic acid
CID 159524024
decanoic acid;bis(dodecanoic acid)
CID 88765096
bis(hexanedioic acid);bis(tridecane)
CID 173306988
decanedioic acid;nonane
CID 25154161
decanoic acid
CID 158633075
decanoic acid;hexanedioic acid
CID 87189912
dodecanoic acid
CID 158187269

Frequently Asked Questions

What is the IUPAC name of decanoic acid;phosphorous acid?
The IUPAC name of decanoic acid;phosphorous acid (CID 158036968) is decanoic acid;phosphorous acid.
What is the SMILES notation for decanoic acid;phosphorous acid?
The canonical SMILES for decanoic acid;phosphorous acid is CCCCCCCCCC(=O)O.OP(O)O.
What is the InChIKey of decanoic acid;phosphorous acid?
The InChIKey is FHWFZSYPBLJEFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20O2.H3O3P/c1-2-3-4-5-6-7-8-9-10(11)12;1-4(2)3/h2-9H2,1H3,(H,11,12);1-3H.
What are the key properties of decanoic acid;phosphorous acid?
decanoic acid;phosphorous acid has a molecular weight of 254.26 g/mol, XLogP of 2.40, 8 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for decanoic acid;phosphorous acid is sourced from PubChem (CID 158036968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).