(Z)-1-(3,5-dichlorophenyl)-N-methoxymethanimine

C8H7Cl2NO — CID 88631268

IUPAC(Z)-1-(3,5-dichlorophenyl)-N-methoxymethanimine
SMILESCO/N=C\c1cc(Cl)cc(Cl)c1
InChIInChI=1S/C8H7Cl2NO/c1-12-11-5-6-2-7(9)4-8(10)3-6/h2-5H,1H3/b11-5-
InChIKeyUMRMZCPZXOQDFW-WZUFQYTHSA-N
MW204.06 g/mol
LogP2.97
Rot. Bonds2

About (Z)-1-(3,5-dichlorophenyl)-N-methoxymethanimine

(Z)-1-(3,5-dichlorophenyl)-N-methoxymethanimine (PubChem CID 88631268) has the molecular formula C8H7Cl2NO and a molecular weight of 204.06 g/mol. Its IUPAC name is (Z)-1-(3,5-dichlorophenyl)-N-methoxymethanimine.

Molecular Properties

Compound Name(Z)-1-(3,5-dichlorophenyl)-N-methoxymethanimine
PubChem CID88631268
Molecular FormulaC8H7Cl2NO
Molecular Weight204.06 g/mol
Exact Mass202.99
IUPAC Name(Z)-1-(3,5-dichlorophenyl)-N-methoxymethanimine
SMILESCO/N=C\c1cc(Cl)cc(Cl)c1
InChIInChI=1S/C8H7Cl2NO/c1-12-11-5-6-2-7(9)4-8(10)3-6/h2-5H,1H3/b11-5-
InChIKeyUMRMZCPZXOQDFW-WZUFQYTHSA-N
XLogP2.97
TPSA21.59 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.06
LogP ≤ 52.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_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 (Z)-1-(3,5-dichlorophenyl)-N-methoxymethanimine?
The IUPAC name of (Z)-1-(3,5-dichlorophenyl)-N-methoxymethanimine (CID 88631268) is (Z)-1-(3,5-dichlorophenyl)-N-methoxymethanimine.
What is the SMILES notation for (Z)-1-(3,5-dichlorophenyl)-N-methoxymethanimine?
The canonical SMILES for (Z)-1-(3,5-dichlorophenyl)-N-methoxymethanimine is CO/N=C\c1cc(Cl)cc(Cl)c1.
What is the InChIKey of (Z)-1-(3,5-dichlorophenyl)-N-methoxymethanimine?
The InChIKey is UMRMZCPZXOQDFW-WZUFQYTHSA-N. The full InChI is InChI=1S/C8H7Cl2NO/c1-12-11-5-6-2-7(9)4-8(10)3-6/h2-5H,1H3/b11-5-.
What are the key properties of (Z)-1-(3,5-dichlorophenyl)-N-methoxymethanimine?
(Z)-1-(3,5-dichlorophenyl)-N-methoxymethanimine has a molecular weight of 204.06 g/mol, XLogP of 2.97, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-1-(3,5-dichlorophenyl)-N-methoxymethanimine is sourced from PubChem (CID 88631268), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).