4-(dimethylamino)-2,5-dimethoxybenzenediazonium;zinc;chloride;hydrochloride

C10H15Cl2N3O2Zn — CID 173365483

IUPAC4-(dimethylamino)-2,5-dimethoxybenzenediazonium;zinc;chloride;hydrochloride
SMILESCOc1cc(N(C)C)c(OC)cc1[N+]#N.Cl.[Cl-].[Zn]
InChIInChI=1S/C10H14N3O2.2ClH.Zn/c1-13(2)8-6-9(14-3)7(12-11)5-10(8)15-4;;;/h5-6H,1-4H3;2*1H;/q+1;;;/p-1
InChIKeyIEIJCYPSTNMRAU-UHFFFAOYSA-M
MW345.55 g/mol
LogP-0.32
Rot. Bonds3

About 4-(dimethylamino)-2,5-dimethoxybenzenediazonium;zinc;chloride;hydrochloride

4-(dimethylamino)-2,5-dimethoxybenzenediazonium;zinc;chloride;hydrochloride (PubChem CID 173365483) has the molecular formula C10H15Cl2N3O2Zn and a molecular weight of 345.55 g/mol. Its IUPAC name is 4-(dimethylamino)-2,5-dimethoxybenzenediazonium;zinc;chloride;hydrochloride.

Molecular Properties

Compound Name4-(dimethylamino)-2,5-dimethoxybenzenediazonium;zinc;chloride;hydrochloride
PubChem CID173365483
Molecular FormulaC10H15Cl2N3O2Zn
Molecular Weight345.55 g/mol
Exact Mass342.98
IUPAC Name4-(dimethylamino)-2,5-dimethoxybenzenediazonium;zinc;chloride;hydrochloride
SMILESCOc1cc(N(C)C)c(OC)cc1[N+]#N.Cl.[Cl-].[Zn]
InChIInChI=1S/C10H14N3O2.2ClH.Zn/c1-13(2)8-6-9(14-3)7(12-11)5-10(8)15-4;;;/h5-6H,1-4H3;2*1H;/q+1;;;/p-1
InChIKeyIEIJCYPSTNMRAU-UHFFFAOYSA-M
XLogP-0.32
TPSA49.85 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.55
LogP ≤ 5-0.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

5-(dimethylamino)-2-methoxybenzenediazonium
CID 57013987
4-(dimethylamino)-2,5-diethoxybenzenediazonium;pentafluoro-λ5-phosphane;fluoride
CID 91157383
2-methoxy-N,N,4,5-tetramethylaniline
CID 117043608
4-(dimethylamino)-3-methoxybenzenediazonium tetrafluoroborate
CID 157402997
4,5-dimethoxy-2-N,2-N-dimethylbenzene-1,2-diamine
CID 68606067
zinc;bis(2,5-dimethoxy-4-pyrrolidin-1-ylbenzenediazonium);tetrachloride
CID 170853886
4-(dimethylamino)-2,3-dimethoxybenzenediazonium
CID 88702943
4-(1-aminopropan-2-yl)-2,5-dimethoxy-N,N-dimethylaniline
CID 117349624
zinc;4-(dimethylamino)-2,5-dimethylbenzenediazonium;trichloride
CID 173416980
5-chloro-2-methoxybenzenediazonium;dichlorozinc;chloride
CID 53442212
2-chloro-5-methoxy-1-N,1-N-dimethylbenzene-1,4-diamine
CID 54032840
3-[4-(dimethylamino)-2,5-dimethoxyphenyl]-1-methylpyrazol-5-amine
CID 117442658

Frequently Asked Questions

What is the IUPAC name of 4-(dimethylamino)-2,5-dimethoxybenzenediazonium;zinc;chloride;hydrochloride?
The IUPAC name of 4-(dimethylamino)-2,5-dimethoxybenzenediazonium;zinc;chloride;hydrochloride (CID 173365483) is 4-(dimethylamino)-2,5-dimethoxybenzenediazonium;zinc;chloride;hydrochloride.
What is the SMILES notation for 4-(dimethylamino)-2,5-dimethoxybenzenediazonium;zinc;chloride;hydrochloride?
The canonical SMILES for 4-(dimethylamino)-2,5-dimethoxybenzenediazonium;zinc;chloride;hydrochloride is COc1cc(N(C)C)c(OC)cc1[N+]#N.Cl.[Cl-].[Zn].
What is the InChIKey of 4-(dimethylamino)-2,5-dimethoxybenzenediazonium;zinc;chloride;hydrochloride?
The InChIKey is IEIJCYPSTNMRAU-UHFFFAOYSA-M. The full InChI is InChI=1S/C10H14N3O2.2ClH.Zn/c1-13(2)8-6-9(14-3)7(12-11)5-10(8)15-4;;;/h5-6H,1-4H3;2*1H;/q+1;;;/p-1.
What are the key properties of 4-(dimethylamino)-2,5-dimethoxybenzenediazonium;zinc;chloride;hydrochloride?
4-(dimethylamino)-2,5-dimethoxybenzenediazonium;zinc;chloride;hydrochloride has a molecular weight of 345.55 g/mol, XLogP of -0.32, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(dimethylamino)-2,5-dimethoxybenzenediazonium;zinc;chloride;hydrochloride is sourced from PubChem (CID 173365483), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).