chloromethane;palladium(2+);(NE)-N-(1-phenylethylidene)hydroxylamine

C9H10ClNOPd — CID 134971535

IUPACchloromethane;palladium(2+);(NE)-N-(1-phenylethylidene)hydroxylamine
SMILESC/C(=N\O)c1[c-]cccc1.[CH2-]Cl.[Pd+2]
InChIInChI=1S/C8H8NO.CH2Cl.Pd/c1-7(9-10)8-5-3-2-4-6-8;1-2;/h2-5,10H,1H3;1H2;/q2*-1;+2/b9-7+;;
InChIKeyMOYBHHILWFMPMF-OJYIHNBOSA-N
MW290.06 g/mol
LogP2.70
Rot. Bonds1

About chloromethane;palladium(2+);(NE)-N-(1-phenylethylidene)hydroxylamine

chloromethane;palladium(2+);(NE)-N-(1-phenylethylidene)hydroxylamine (PubChem CID 134971535) has the molecular formula C9H10ClNOPd and a molecular weight of 290.06 g/mol. Its IUPAC name is chloromethane;palladium(2+);(NE)-N-(1-phenylethylidene)hydroxylamine.

Molecular Properties

Compound Namechloromethane;palladium(2+);(NE)-N-(1-phenylethylidene)hydroxylamine
PubChem CID134971535
Molecular FormulaC9H10ClNOPd
Molecular Weight290.06 g/mol
Exact Mass288.95
IUPAC Namechloromethane;palladium(2+);(NE)-N-(1-phenylethylidene)hydroxylamine
SMILESC/C(=N\O)c1[c-]cccc1.[CH2-]Cl.[Pd+2]
InChIInChI=1S/C8H8NO.CH2Cl.Pd/c1-7(9-10)8-5-3-2-4-6-8;1-2;/h2-5,10H,1H3;1H2;/q2*-1;+2/b9-7+;;
InChIKeyMOYBHHILWFMPMF-OJYIHNBOSA-N
XLogP2.70
TPSA32.59 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.06
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'oxime_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of chloromethane;palladium(2+);(NE)-N-(1-phenylethylidene)hydroxylamine?
The IUPAC name of chloromethane;palladium(2+);(NE)-N-(1-phenylethylidene)hydroxylamine (CID 134971535) is chloromethane;palladium(2+);(NE)-N-(1-phenylethylidene)hydroxylamine.
What is the SMILES notation for chloromethane;palladium(2+);(NE)-N-(1-phenylethylidene)hydroxylamine?
The canonical SMILES for chloromethane;palladium(2+);(NE)-N-(1-phenylethylidene)hydroxylamine is C/C(=N\O)c1[c-]cccc1.[CH2-]Cl.[Pd+2].
What is the InChIKey of chloromethane;palladium(2+);(NE)-N-(1-phenylethylidene)hydroxylamine?
The InChIKey is MOYBHHILWFMPMF-OJYIHNBOSA-N. The full InChI is InChI=1S/C8H8NO.CH2Cl.Pd/c1-7(9-10)8-5-3-2-4-6-8;1-2;/h2-5,10H,1H3;1H2;/q2*-1;+2/b9-7+;;.
What are the key properties of chloromethane;palladium(2+);(NE)-N-(1-phenylethylidene)hydroxylamine?
chloromethane;palladium(2+);(NE)-N-(1-phenylethylidene)hydroxylamine has a molecular weight of 290.06 g/mol, XLogP of 2.70, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for chloromethane;palladium(2+);(NE)-N-(1-phenylethylidene)hydroxylamine is sourced from PubChem (CID 134971535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).