amino(phenyl)methanediazonium chloride

C7H8ClN3 — CID 160978271

IUPACamino(phenyl)methanediazonium chloride
SMILESN#[N+]C(N)c1ccccc1.[Cl-]
InChIInChI=1S/C7H8N3.ClH/c8-7(10-9)6-4-2-1-3-5-6;/h1-5,7H,8H2;1H/q+1;/p-1
InChIKeySZEADGADVTXRFD-UHFFFAOYSA-M
MW169.62 g/mol
LogP-1.50
Rot. Bonds1

About amino(phenyl)methanediazonium chloride

amino(phenyl)methanediazonium chloride (PubChem CID 160978271) has the molecular formula C7H8ClN3 and a molecular weight of 169.62 g/mol. Its IUPAC name is amino(phenyl)methanediazonium chloride.

Molecular Properties

Compound Nameamino(phenyl)methanediazonium chloride
PubChem CID160978271
Molecular FormulaC7H8ClN3
Molecular Weight169.62 g/mol
Exact Mass169.04
IUPAC Nameamino(phenyl)methanediazonium chloride
SMILESN#[N+]C(N)c1ccccc1.[Cl-]
InChIInChI=1S/C7H8N3.ClH/c8-7(10-9)6-4-2-1-3-5-6;/h1-5,7H,8H2;1H/q+1;/p-1
InChIKeySZEADGADVTXRFD-UHFFFAOYSA-M
XLogP-1.50
TPSA54.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.62
LogP ≤ 5-1.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Azo_group', 'substructure': 'N/A'}

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Related Compounds

[amino(phenyl)methyl]-triphenylphosphanium
CID 174402804
benzenediazonium;zinc;dichloride
CID 158959477
CID 140568629
CID 140568629
diphenylmethanamine;methanethiol
CID 143873840
(R)-[2-[(S)-hydroxy(phenyl)methyl]phenyl]-phenylmethanol
CID 92542463
1,2,3-triphenylpropane-1,3-diamine
CID 67052848
bromo(phenyl)methanamine;hydroiodide
CID 175393432
ethane;(1R)-1-phenylethanamine
CID 142977390
zinc;tris((2S)-2-amino-2-phenylethanol);dichloride
CID 175904832
2,2-diphenyl-1-pyridin-3-ylethanamine
CID 60923262
(1R,2R)-2-fluoro-1,2-diphenylethanamine
CID 12617058
S-[amino(phenyl)methyl]thiohydroxylamine
CID 144591958

Frequently Asked Questions

What is the IUPAC name of amino(phenyl)methanediazonium chloride?
The IUPAC name of amino(phenyl)methanediazonium chloride (CID 160978271) is amino(phenyl)methanediazonium chloride.
What is the SMILES notation for amino(phenyl)methanediazonium chloride?
The canonical SMILES for amino(phenyl)methanediazonium chloride is N#[N+]C(N)c1ccccc1.[Cl-].
What is the InChIKey of amino(phenyl)methanediazonium chloride?
The InChIKey is SZEADGADVTXRFD-UHFFFAOYSA-M. The full InChI is InChI=1S/C7H8N3.ClH/c8-7(10-9)6-4-2-1-3-5-6;/h1-5,7H,8H2;1H/q+1;/p-1.
What are the key properties of amino(phenyl)methanediazonium chloride?
amino(phenyl)methanediazonium chloride has a molecular weight of 169.62 g/mol, XLogP of -1.50, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for amino(phenyl)methanediazonium chloride is sourced from PubChem (CID 160978271), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).