sodium;4-chloro-1H-indazole;hydride

C7H6ClN2Na — CID 175559887

IUPACsodium;4-chloro-1H-indazole;hydride
SMILESClc1cccc2[nH]ncc12.[H-].[Na+]
InChIInChI=1S/C7H5ClN2.Na.H/c8-6-2-1-3-7-5(6)4-9-10-7;;/h1-4H,(H,9,10);;/q;+1;-1
InChIKeyWWRCUWXZJIAMSM-UHFFFAOYSA-N
MW176.58 g/mol
LogP-0.67
Rot. Bonds

About sodium;4-chloro-1H-indazole;hydride

sodium;4-chloro-1H-indazole;hydride (PubChem CID 175559887) has the molecular formula C7H6ClN2Na and a molecular weight of 176.58 g/mol. Its IUPAC name is sodium;4-chloro-1H-indazole;hydride.

Molecular Properties

Compound Namesodium;4-chloro-1H-indazole;hydride
PubChem CID175559887
Molecular FormulaC7H6ClN2Na
Molecular Weight176.58 g/mol
Exact Mass176.01
IUPAC Namesodium;4-chloro-1H-indazole;hydride
SMILESClc1cccc2[nH]ncc12.[H-].[Na+]
InChIInChI=1S/C7H5ClN2.Na.H/c8-6-2-1-3-7-5(6)4-9-10-7;;/h1-4H,(H,9,10);;/q;+1;-1
InChIKeyWWRCUWXZJIAMSM-UHFFFAOYSA-N
XLogP-0.67
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.58
LogP ≤ 5-0.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of sodium;4-chloro-1H-indazole;hydride?
The IUPAC name of sodium;4-chloro-1H-indazole;hydride (CID 175559887) is sodium;4-chloro-1H-indazole;hydride.
What is the SMILES notation for sodium;4-chloro-1H-indazole;hydride?
The canonical SMILES for sodium;4-chloro-1H-indazole;hydride is Clc1cccc2[nH]ncc12.[H-].[Na+].
What is the InChIKey of sodium;4-chloro-1H-indazole;hydride?
The InChIKey is WWRCUWXZJIAMSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H5ClN2.Na.H/c8-6-2-1-3-7-5(6)4-9-10-7;;/h1-4H,(H,9,10);;/q;+1;-1.
What are the key properties of sodium;4-chloro-1H-indazole;hydride?
sodium;4-chloro-1H-indazole;hydride has a molecular weight of 176.58 g/mol, XLogP of -0.67, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for sodium;4-chloro-1H-indazole;hydride is sourced from PubChem (CID 175559887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).