sodium;chlorobenzene;hydride

C6H6ClNa — CID 173115235

IUPACsodium;chlorobenzene;hydride
SMILESClc1ccccc1.[H-].[Na+]
InChIInChI=1S/C6H5Cl.Na.H/c7-6-4-2-1-3-5-6;;/h1-5H;;/q;+1;-1
InChIKeyDNDIPKWMODNNBM-UHFFFAOYSA-N
MW136.56 g/mol
LogP-0.54
Rot. Bonds

About sodium;chlorobenzene;hydride

sodium;chlorobenzene;hydride (PubChem CID 173115235) has the molecular formula C6H6ClNa and a molecular weight of 136.56 g/mol. Its IUPAC name is sodium;chlorobenzene;hydride.

Molecular Properties

Compound Namesodium;chlorobenzene;hydride
PubChem CID173115235
Molecular FormulaC6H6ClNa
Molecular Weight136.56 g/mol
Exact Mass136.01
IUPAC Namesodium;chlorobenzene;hydride
SMILESClc1ccccc1.[H-].[Na+]
InChIInChI=1S/C6H5Cl.Na.H/c7-6-4-2-1-3-5-6;;/h1-5H;;/q;+1;-1
InChIKeyDNDIPKWMODNNBM-UHFFFAOYSA-N
XLogP-0.54
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500136.56
LogP ≤ 5-0.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of sodium;chlorobenzene;hydride?
The IUPAC name of sodium;chlorobenzene;hydride (CID 173115235) is sodium;chlorobenzene;hydride.
What is the SMILES notation for sodium;chlorobenzene;hydride?
The canonical SMILES for sodium;chlorobenzene;hydride is Clc1ccccc1.[H-].[Na+].
What is the InChIKey of sodium;chlorobenzene;hydride?
The InChIKey is DNDIPKWMODNNBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H5Cl.Na.H/c7-6-4-2-1-3-5-6;;/h1-5H;;/q;+1;-1.
What are the key properties of sodium;chlorobenzene;hydride?
sodium;chlorobenzene;hydride has a molecular weight of 136.56 g/mol, XLogP of -0.54, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for sodium;chlorobenzene;hydride is sourced from PubChem (CID 173115235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).