chlorodiazene

HClN2 — CID 20778768

IUPACchlorodiazene
SMILES[H]/N=N/Cl
InChIInChI=1S/ClHN2/c1-3-2/h2H/b3-2+
InChIKeyCESPBGQCVDCTIW-NSCUHMNNSA-N
MW64.47 g/mol
LogP1.17
Rot. Bonds

About chlorodiazene

chlorodiazene (PubChem CID 20778768) has the molecular formula HClN2 and a molecular weight of 64.47 g/mol. Its IUPAC name is chlorodiazene.

Molecular Properties

Compound Namechlorodiazene
PubChem CID20778768
Molecular FormulaHClN2
Molecular Weight64.47 g/mol
Exact Mass63.98
IUPAC Namechlorodiazene
SMILES[H]/N=N/Cl
InChIInChI=1S/ClHN2/c1-3-2/h2H/b3-2+
InChIKeyCESPBGQCVDCTIW-NSCUHMNNSA-N
XLogP1.17
TPSA36.21 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms3
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50064.47
LogP ≤ 51.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}

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Related Compounds

Dichlorotriazene
CID 21977419
Chlorotriazene
CID 22134374
Diimide hydrochloride
CID 129724637
CID 58065563
CID 58065563
(Z)-chloro(diazenyl)diazene
CID 58757067
Chloroiminoazanium
CID 59483577
(E)-chloro(diazenyl)diazene
CID 59622974
CID 59829784
CID 59829784
(Z)-chloro-[(E)-diazenyldiazenyl]diazene
CID 59902401
Chloro(diazenyl)diazene
CID 72414320
CID 73857268
CID 73857268
CID 73866696
CID 73866696

Frequently Asked Questions

What is the IUPAC name of chlorodiazene?
The IUPAC name of chlorodiazene (CID 20778768) is chlorodiazene.
What is the SMILES notation for chlorodiazene?
The canonical SMILES for chlorodiazene is [H]/N=N/Cl.
What is the InChIKey of chlorodiazene?
The InChIKey is CESPBGQCVDCTIW-NSCUHMNNSA-N. The full InChI is InChI=1S/ClHN2/c1-3-2/h2H/b3-2+.
What are the key properties of chlorodiazene?
chlorodiazene has a molecular weight of 64.47 g/mol, XLogP of 1.17, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for chlorodiazene is sourced from PubChem (CID 20778768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).