silver 5-methoxy-2H-benzotriazol-4-ol

C7H7AgN3O2+ — CID 135617169

IUPACsilver 5-methoxy-2H-benzotriazol-4-ol
SMILESCOc1ccc2n[nH]nc2c1O.[Ag+]
InChIInChI=1S/C7H7N3O2.Ag/c1-12-5-3-2-4-6(7(5)11)9-10-8-4;/h2-3,11H,1H3,(H,8,9,10);/q;+1
InChIKeyAHSDTGWOQUPLBI-UHFFFAOYSA-N
MW273.02 g/mol
LogP0.67
Rot. Bonds1

About silver 5-methoxy-2H-benzotriazol-4-ol

silver 5-methoxy-2H-benzotriazol-4-ol (PubChem CID 135617169) has the molecular formula C7H7AgN3O2+ and a molecular weight of 273.02 g/mol. Its IUPAC name is silver 5-methoxy-2H-benzotriazol-4-ol.

Molecular Properties

Compound Namesilver 5-methoxy-2H-benzotriazol-4-ol
PubChem CID135617169
Molecular FormulaC7H7AgN3O2+
Molecular Weight273.02 g/mol
Exact Mass271.96
IUPAC Namesilver 5-methoxy-2H-benzotriazol-4-ol
SMILESCOc1ccc2n[nH]nc2c1O.[Ag+]
InChIInChI=1S/C7H7N3O2.Ag/c1-12-5-3-2-4-6(7(5)11)9-10-8-4;/h2-3,11H,1H3,(H,8,9,10);/q;+1
InChIKeyAHSDTGWOQUPLBI-UHFFFAOYSA-N
XLogP0.67
TPSA71.03 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.02
LogP ≤ 50.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-hydroxy-2H-benzotriazole-5-carboxylic acid
CID 135423839
5-hydroxy-4-(5-methoxy-2H-benzotriazol-4-yl)cyclohex-3-en-1-one
CID 54440191
2-(2H-benzotriazol-4-yloxy)-6-methylphenol
CID 175070691
3,6-dimethoxy-2-methylphenol
CID 13158257
2-(2H-benzotriazol-4-ylmethyl)-7-methoxy-1H-benzimidazole-4-carboxylic acid
CID 67073794
2-hydroxy-6-(3-hydroxyprop-1-enyl)-3-methoxybenzaldehyde
CID 169453822
3-hydroxy-4-methoxy-2-prop-2-enoxybenzaldehyde
CID 86025869
ethane;6-methoxy-2-methylindazol-7-ol
CID 155591258
2-(2,3-dihydroxy-4-methoxyphenyl)acetaldehyde
CID 87549008
6-methoxy-3-methyl-2-propylphenol
CID 170766303
7-ethyl-2-[(8-hydroxy-7-methoxyquinolin-2-yl)methyl]quinolin-8-ol
CID 70973017
2-(6-methoxy-2H-benzotriazol-5-yl)acetic acid
CID 175360709

Frequently Asked Questions

What is the IUPAC name of silver 5-methoxy-2H-benzotriazol-4-ol?
The IUPAC name of silver 5-methoxy-2H-benzotriazol-4-ol (CID 135617169) is silver 5-methoxy-2H-benzotriazol-4-ol.
What is the SMILES notation for silver 5-methoxy-2H-benzotriazol-4-ol?
The canonical SMILES for silver 5-methoxy-2H-benzotriazol-4-ol is COc1ccc2n[nH]nc2c1O.[Ag+].
What is the InChIKey of silver 5-methoxy-2H-benzotriazol-4-ol?
The InChIKey is AHSDTGWOQUPLBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7N3O2.Ag/c1-12-5-3-2-4-6(7(5)11)9-10-8-4;/h2-3,11H,1H3,(H,8,9,10);/q;+1.
What are the key properties of silver 5-methoxy-2H-benzotriazol-4-ol?
silver 5-methoxy-2H-benzotriazol-4-ol has a molecular weight of 273.02 g/mol, XLogP of 0.67, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for silver 5-methoxy-2H-benzotriazol-4-ol is sourced from PubChem (CID 135617169), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).