dichloro-(dimethylamino)-methylphosphanium

C3H9Cl2NP+ — CID 23415109

IUPACdichloro-(dimethylamino)-methylphosphanium
SMILESCN(C)[P+](C)(Cl)Cl
InChIInChI=1S/C3H9Cl2NP/c1-6(2)7(3,4)5/h1-3H3/q+1
InChIKeyCXDYBNCNFODIMQ-UHFFFAOYSA-N
MW160.99 g/mol
LogP2.42
Rot. Bonds1

About dichloro-(dimethylamino)-methylphosphanium

dichloro-(dimethylamino)-methylphosphanium (PubChem CID 23415109) has the molecular formula C3H9Cl2NP+ and a molecular weight of 160.99 g/mol. Its IUPAC name is dichloro-(dimethylamino)-methylphosphanium.

Molecular Properties

Compound Namedichloro-(dimethylamino)-methylphosphanium
PubChem CID23415109
Molecular FormulaC3H9Cl2NP+
Molecular Weight160.99 g/mol
Exact Mass159.98
IUPAC Namedichloro-(dimethylamino)-methylphosphanium
SMILESCN(C)[P+](C)(Cl)Cl
InChIInChI=1S/C3H9Cl2NP/c1-6(2)7(3,4)5/h1-3H3/q+1
InChIKeyCXDYBNCNFODIMQ-UHFFFAOYSA-N
XLogP2.42
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.99
LogP ≤ 52.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

Dimethylphosphoramidous dichloride
CID 136483
N-[chloro(methyl)phosphanyl]-N-methylmethanamine
CID 14437099
N-[chloro(chloromethyl)phosphanyl]-N-methylmethanamine
CID 23280642
N-methyl-N-methylidenephosphanylmethanamine
CID 634983
N-[dichloro(methylidene)-lambda5-phosphanyl]-N-methylmethanamine
CID 89102195
N-methyl-N-phosphanylmethanamine;dihydrochloride
CID 174755952
Trichloro(dimethylamino)phosphanium
CID 23414994

Frequently Asked Questions

What is the IUPAC name of dichloro-(dimethylamino)-methylphosphanium?
The IUPAC name of dichloro-(dimethylamino)-methylphosphanium (CID 23415109) is dichloro-(dimethylamino)-methylphosphanium.
What is the SMILES notation for dichloro-(dimethylamino)-methylphosphanium?
The canonical SMILES for dichloro-(dimethylamino)-methylphosphanium is CN(C)[P+](C)(Cl)Cl.
What is the InChIKey of dichloro-(dimethylamino)-methylphosphanium?
The InChIKey is CXDYBNCNFODIMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H9Cl2NP/c1-6(2)7(3,4)5/h1-3H3/q+1.
What are the key properties of dichloro-(dimethylamino)-methylphosphanium?
dichloro-(dimethylamino)-methylphosphanium has a molecular weight of 160.99 g/mol, XLogP of 2.42, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for dichloro-(dimethylamino)-methylphosphanium is sourced from PubChem (CID 23415109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).