methanamine;phosphoric acid

CH14NO12P3 — CID 173433743

IUPACmethanamine;phosphoric acid
SMILESCN.O=P(O)(O)O.O=P(O)(O)O.O=P(O)(O)O
InChIInChI=1S/CH5N.3H3O4P/c1-2;3*1-5(2,3)4/h2H2,1H3;3*(H3,1,2,3,4)
InChIKeyJVIKFAIWBYPEDF-UHFFFAOYSA-N
MW325.04 g/mol
LogP-3.21
Rot. Bonds

About methanamine;phosphoric acid

methanamine;phosphoric acid (PubChem CID 173433743) has the molecular formula CH14NO12P3 and a molecular weight of 325.04 g/mol. Its IUPAC name is methanamine;phosphoric acid.

Molecular Properties

Compound Namemethanamine;phosphoric acid
PubChem CID173433743
Molecular FormulaCH14NO12P3
Molecular Weight325.04 g/mol
Exact Mass324.97
IUPAC Namemethanamine;phosphoric acid
SMILESCN.O=P(O)(O)O.O=P(O)(O)O.O=P(O)(O)O
InChIInChI=1S/CH5N.3H3O4P/c1-2;3*1-5(2,3)4/h2H2,1H3;3*(H3,1,2,3,4)
InChIKeyJVIKFAIWBYPEDF-UHFFFAOYSA-N
XLogP-3.21
TPSA259.30 Ų
H-Bond Donors10
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500325.04
LogP ≤ 5-3.21
H-Bond Donors ≤ 510
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

hydroxylamine;phosphoric acid
CID 160630292
azane;hydroxylamine;phosphoric acid
CID 173277328
CID 162132831
CID 162132831
alumane;ethane;phosphoric acid
CID 173118040
phosphoric acid;titanium
CID 139211571
phosphoric acid;trihydrate
CID 18988970
azane;phosphoric acid
CID 174789402
argon;phosphoric acid
CID 157300411
CID 131878072
CID 131878072
iron;phosphoric acid
CID 175001141
phosphane;phosphoric acid
CID 172840180
phosphoric acid;hydrate
CID 22023151

Frequently Asked Questions

What is the IUPAC name of methanamine;phosphoric acid?
The IUPAC name of methanamine;phosphoric acid (CID 173433743) is methanamine;phosphoric acid.
What is the SMILES notation for methanamine;phosphoric acid?
The canonical SMILES for methanamine;phosphoric acid is CN.O=P(O)(O)O.O=P(O)(O)O.O=P(O)(O)O.
What is the InChIKey of methanamine;phosphoric acid?
The InChIKey is JVIKFAIWBYPEDF-UHFFFAOYSA-N. The full InChI is InChI=1S/CH5N.3H3O4P/c1-2;3*1-5(2,3)4/h2H2,1H3;3*(H3,1,2,3,4).
What are the key properties of methanamine;phosphoric acid?
methanamine;phosphoric acid has a molecular weight of 325.04 g/mol, XLogP of -3.21, 0 rotatable bonds, 10 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methanamine;phosphoric acid is sourced from PubChem (CID 173433743), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).