CID 154406351

HCl2N3 — CID 154406351

IUPAC—
SMILES[H]/N=N/N(Cl)Cl
InChIInChI=1S/Cl2HN3/c1-5(2)4-3/h3H/b4-3+
InChIKeyRSSVIULUQOJCMD-ONEGZZNKSA-N
MW113.94 g/mol
LogP1.54
Rot. Bonds1

About CID 154406351

CID 154406351 (PubChem CID 154406351) has the molecular formula HCl2N3 and a molecular weight of 113.94 g/mol.

Molecular Properties

Compound NameCID 154406351
PubChem CID154406351
Molecular FormulaHCl2N3
Molecular Weight113.94 g/mol
Exact Mass112.95
IUPAC Name—
SMILES[H]/N=N/N(Cl)Cl
InChIInChI=1S/Cl2HN3/c1-5(2)4-3/h3H/b4-3+
InChIKeyRSSVIULUQOJCMD-ONEGZZNKSA-N
XLogP1.54
TPSA39.45 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500113.94
LogP ≤ 51.54
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'}, {'alert_name': 'N-halo', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-diazenyl-N-methylmethanamine
CID 15178355
chlorodiazene
CID 20778768
sodium N-diazenyl-N-ethylethanamine
CID 172778091
carboxy(diazenyl)carbamic acid
CID 21461025
N'-(2-aminoethyl)-N'-diazenylethane-1,2-diamine
CID 87672155
4-chloro-N-diazenyl-N-methylaniline
CID 167081565
N-diazenyl-N,3-dimethylbutan-2-amine
CID 146507208
2-[diazenyl(oxido)amino]propan-2-ol
CID 163568258
N-diazenyl-2-methyl-N-(methylamino)propan-2-amine
CID 146512453
[diazenyl(oxido)amino]oxyiminomethane
CID 163841078
diazenyldiazene
CID 19878547
N'-methanimidoyl-N,N-dimethylmethanimidamide
CID 154515557

Frequently Asked Questions

What is the IUPAC name of CID 154406351?
The IUPAC name of CID 154406351 (CID 154406351) is not available.
What is the SMILES notation for CID 154406351?
The canonical SMILES for CID 154406351 is [H]/N=N/N(Cl)Cl.
What is the InChIKey of CID 154406351?
The InChIKey is RSSVIULUQOJCMD-ONEGZZNKSA-N. The full InChI is InChI=1S/Cl2HN3/c1-5(2)4-3/h3H/b4-3+.
What are the key properties of CID 154406351?
CID 154406351 has a molecular weight of 113.94 g/mol, XLogP of 1.54, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 154406351 is sourced from PubChem (CID 154406351), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).