2-methoxybenzenediazonium chloride

C7H7ClN2O — CID 10920957

IUPAC2-methoxybenzenediazonium chloride
SMILESCOc1ccccc1[N+]#N.[Cl-]
InChIInChI=1S/C7H7N2O.ClH/c1-10-7-5-3-2-4-6(7)9-8;/h2-5H,1H3;1H/q+1;/p-1
InChIKeyXUEJWOZUNYWFCY-UHFFFAOYSA-M
MW170.60 g/mol
LogP-0.82
Rot. Bonds1

About 2-methoxybenzenediazonium chloride

2-methoxybenzenediazonium chloride (PubChem CID 10920957) has the molecular formula C7H7ClN2O and a molecular weight of 170.60 g/mol. Its IUPAC name is 2-methoxybenzenediazonium chloride.

Molecular Properties

Compound Name2-methoxybenzenediazonium chloride
PubChem CID10920957
Molecular FormulaC7H7ClN2O
Molecular Weight170.60 g/mol
Exact Mass170.02
IUPAC Name2-methoxybenzenediazonium chloride
SMILESCOc1ccccc1[N+]#N.[Cl-]
InChIInChI=1S/C7H7N2O.ClH/c1-10-7-5-3-2-4-6(7)9-8;/h2-5H,1H3;1H/q+1;/p-1
InChIKeyXUEJWOZUNYWFCY-UHFFFAOYSA-M
XLogP-0.82
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.60
LogP ≤ 5-0.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-(4-methoxyphenoxy)benzenediazonium
CID 10358242
1-isocyano-2-methoxybenzene
CID 583673
2-(4-methoxyphenoxy)benzenediazonium tetrafluoroborate
CID 10358241
2,3-dimethoxybenzenediazonium tetratetrafluoroborate
CID 173431119
2-diazonio-6-methoxybenzoate
CID 134897591
1,2-dimethoxybenzene;molecular nitrogen;hydrochloride
CID 173306958
1,2-dimethoxybenzene;dihydrochloride
CID 19834650
azane;1,2-dimethoxybenzene
CID 174437926
2-methoxypyridine-3-diazonium
CID 175142143
4-anilino-2-methoxybenzenediazonium bromide
CID 19770680
5-chloro-2-methoxybenzenediazonium;dichlorozinc;chloride
CID 53442212
(E)-2-hydroxy-1,2-bis(2-methoxyphenyl)ethenediazonium
CID 11022356

Frequently Asked Questions

What is the IUPAC name of 2-methoxybenzenediazonium chloride?
The IUPAC name of 2-methoxybenzenediazonium chloride (CID 10920957) is 2-methoxybenzenediazonium chloride.
What is the SMILES notation for 2-methoxybenzenediazonium chloride?
The canonical SMILES for 2-methoxybenzenediazonium chloride is COc1ccccc1[N+]#N.[Cl-].
What is the InChIKey of 2-methoxybenzenediazonium chloride?
The InChIKey is XUEJWOZUNYWFCY-UHFFFAOYSA-M. The full InChI is InChI=1S/C7H7N2O.ClH/c1-10-7-5-3-2-4-6(7)9-8;/h2-5H,1H3;1H/q+1;/p-1.
What are the key properties of 2-methoxybenzenediazonium chloride?
2-methoxybenzenediazonium chloride has a molecular weight of 170.60 g/mol, XLogP of -0.82, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxybenzenediazonium chloride is sourced from PubChem (CID 10920957), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).