1-alumanylethane-1,1-diamine;phosphenous acid

C2H10AlN2O2P — CID 175267313

IUPAC1-alumanylethane-1,1-diamine;phosphenous acid
SMILESCC(N)(N)[AlH2].O=PO
InChIInChI=1S/C2H7N2.Al.HO2P.2H/c1-2(3)4;;1-3-2;;/h3-4H2,1H3;;(H,1,2);;
InChIKeyQSCXYKDHAILQDB-UHFFFAOYSA-N
MW152.07 g/mol
LogP-1.60
Rot. Bonds

About 1-alumanylethane-1,1-diamine;phosphenous acid

1-alumanylethane-1,1-diamine;phosphenous acid (PubChem CID 175267313) has the molecular formula C2H10AlN2O2P and a molecular weight of 152.07 g/mol. Its IUPAC name is 1-alumanylethane-1,1-diamine;phosphenous acid.

Molecular Properties

Compound Name1-alumanylethane-1,1-diamine;phosphenous acid
PubChem CID175267313
Molecular FormulaC2H10AlN2O2P
Molecular Weight152.07 g/mol
Exact Mass152.03
IUPAC Name1-alumanylethane-1,1-diamine;phosphenous acid
SMILESCC(N)(N)[AlH2].O=PO
InChIInChI=1S/C2H7N2.Al.HO2P.2H/c1-2(3)4;;1-3-2;;/h3-4H2,1H3;;(H,1,2);;
InChIKeyQSCXYKDHAILQDB-UHFFFAOYSA-N
XLogP-1.60
TPSA89.34 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.07
LogP ≤ 5-1.60
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of 1-alumanylethane-1,1-diamine;phosphenous acid?
The IUPAC name of 1-alumanylethane-1,1-diamine;phosphenous acid (CID 175267313) is 1-alumanylethane-1,1-diamine;phosphenous acid.
What is the SMILES notation for 1-alumanylethane-1,1-diamine;phosphenous acid?
The canonical SMILES for 1-alumanylethane-1,1-diamine;phosphenous acid is CC(N)(N)[AlH2].O=PO.
What is the InChIKey of 1-alumanylethane-1,1-diamine;phosphenous acid?
The InChIKey is QSCXYKDHAILQDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H7N2.Al.HO2P.2H/c1-2(3)4;;1-3-2;;/h3-4H2,1H3;;(H,1,2);;.
What are the key properties of 1-alumanylethane-1,1-diamine;phosphenous acid?
1-alumanylethane-1,1-diamine;phosphenous acid has a molecular weight of 152.07 g/mol, XLogP of -1.60, 0 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-alumanylethane-1,1-diamine;phosphenous acid is sourced from PubChem (CID 175267313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).