propan-2-yl hydrogen phosphite

C3H8O3P- — CID 20501230

IUPACpropan-2-yl hydrogen phosphite
SMILESCC(C)OP([O-])O
InChIInChI=1S/C3H8O3P/c1-3(2)6-7(4)5/h3-4H,1-2H3/q-1
InChIKeyDPNAQKPMCPKLML-UHFFFAOYSA-N
MW123.07 g/mol
LogP-0.01
Rot. Bonds2

About propan-2-yl hydrogen phosphite

propan-2-yl hydrogen phosphite (PubChem CID 20501230) has the molecular formula C3H8O3P- and a molecular weight of 123.07 g/mol. Its IUPAC name is propan-2-yl hydrogen phosphite.

Molecular Properties

Compound Namepropan-2-yl hydrogen phosphite
PubChem CID20501230
Molecular FormulaC3H8O3P-
Molecular Weight123.07 g/mol
Exact Mass123.02
IUPAC Namepropan-2-yl hydrogen phosphite
SMILESCC(C)OP([O-])O
InChIInChI=1S/C3H8O3P/c1-3(2)6-7(4)5/h3-4H,1-2H3/q-1
InChIKeyDPNAQKPMCPKLML-UHFFFAOYSA-N
XLogP-0.01
TPSA52.52 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500123.07
LogP ≤ 5-0.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

methyl(propan-2-yloxy)phosphinite
CID 18981685
sodium propan-2-yl phosphite
CID 21332940
2-methylpropyl(propan-2-yloxy)phosphinous acid
CID 170206646
cobalt;tripropan-2-yl phosphite
CID 175896800
propan-2-yloxy(propyl)phosphinite
CID 18981653
phosphorous acid;tetramethylphosphanium
CID 87583663
diiodo(propan-2-yloxy)phosphane
CID 12507744
bromo-di(propan-2-yloxy)phosphane
CID 13223651
di(propan-2-yloxy)-propylphosphane
CID 57116062
tert-butyl-di(propan-2-yloxy)phosphane
CID 12929625
1-di(propan-2-yloxy)phosphanylethane-1,2-diol
CID 145330650
2-methylpropyl-di(propan-2-yloxy)phosphane
CID 174289830

Frequently Asked Questions

What is the IUPAC name of propan-2-yl hydrogen phosphite?
The IUPAC name of propan-2-yl hydrogen phosphite (CID 20501230) is propan-2-yl hydrogen phosphite.
What is the SMILES notation for propan-2-yl hydrogen phosphite?
The canonical SMILES for propan-2-yl hydrogen phosphite is CC(C)OP([O-])O.
What is the InChIKey of propan-2-yl hydrogen phosphite?
The InChIKey is DPNAQKPMCPKLML-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H8O3P/c1-3(2)6-7(4)5/h3-4H,1-2H3/q-1.
What are the key properties of propan-2-yl hydrogen phosphite?
propan-2-yl hydrogen phosphite has a molecular weight of 123.07 g/mol, XLogP of -0.01, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for propan-2-yl hydrogen phosphite is sourced from PubChem (CID 20501230), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).