zinc;carbanide;chloromethane;hydrate;hydrochloride

C2H8Cl2OZn — CID 87652707

IUPACzinc;carbanide;chloromethane;hydrate;hydrochloride
SMILESCl.O.[CH2-]Cl.[CH3-].[Zn+2]
InChIInChI=1S/CH2Cl.CH3.ClH.H2O.Zn/c1-2;;;;/h1H2;1H3;1H;1H2;/q2*-1;;;+2
InChIKeyHAFPDVRSJLTSBY-UHFFFAOYSA-N
MW184.38 g/mol
LogP1.06
Rot. Bonds

About zinc;carbanide;chloromethane;hydrate;hydrochloride

zinc;carbanide;chloromethane;hydrate;hydrochloride (PubChem CID 87652707) has the molecular formula C2H8Cl2OZn and a molecular weight of 184.38 g/mol. Its IUPAC name is zinc;carbanide;chloromethane;hydrate;hydrochloride.

Molecular Properties

Compound Namezinc;carbanide;chloromethane;hydrate;hydrochloride
PubChem CID87652707
Molecular FormulaC2H8Cl2OZn
Molecular Weight184.38 g/mol
Exact Mass181.92
IUPAC Namezinc;carbanide;chloromethane;hydrate;hydrochloride
SMILESCl.O.[CH2-]Cl.[CH3-].[Zn+2]
InChIInChI=1S/CH2Cl.CH3.ClH.H2O.Zn/c1-2;;;;/h1H2;1H3;1H;1H2;/q2*-1;;;+2
InChIKeyHAFPDVRSJLTSBY-UHFFFAOYSA-N
XLogP1.06
TPSA31.50 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.38
LogP ≤ 51.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of zinc;carbanide;chloromethane;hydrate;hydrochloride?
The IUPAC name of zinc;carbanide;chloromethane;hydrate;hydrochloride (CID 87652707) is zinc;carbanide;chloromethane;hydrate;hydrochloride.
What is the SMILES notation for zinc;carbanide;chloromethane;hydrate;hydrochloride?
The canonical SMILES for zinc;carbanide;chloromethane;hydrate;hydrochloride is Cl.O.[CH2-]Cl.[CH3-].[Zn+2].
What is the InChIKey of zinc;carbanide;chloromethane;hydrate;hydrochloride?
The InChIKey is HAFPDVRSJLTSBY-UHFFFAOYSA-N. The full InChI is InChI=1S/CH2Cl.CH3.ClH.H2O.Zn/c1-2;;;;/h1H2;1H3;1H;1H2;/q2*-1;;;+2.
What are the key properties of zinc;carbanide;chloromethane;hydrate;hydrochloride?
zinc;carbanide;chloromethane;hydrate;hydrochloride has a molecular weight of 184.38 g/mol, XLogP of 1.06, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for zinc;carbanide;chloromethane;hydrate;hydrochloride is sourced from PubChem (CID 87652707), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).