silver 4-hydroxybutyl carbonate

C5H9AgO4 — CID 121333429

IUPACsilver 4-hydroxybutyl carbonate
SMILESO=C([O-])OCCCCO.[Ag+]
InChIInChI=1S/C5H10O4.Ag/c6-3-1-2-4-9-5(7)8;/h6H,1-4H2,(H,7,8);/q;+1/p-1
InChIKeyPQEWXAWDRNFBKH-UHFFFAOYSA-M
MW240.99 g/mol
LogP-0.88
Rot. Bonds4

About silver 4-hydroxybutyl carbonate

silver 4-hydroxybutyl carbonate (PubChem CID 121333429) has the molecular formula C5H9AgO4 and a molecular weight of 240.99 g/mol. Its IUPAC name is silver 4-hydroxybutyl carbonate.

Molecular Properties

Compound Namesilver 4-hydroxybutyl carbonate
PubChem CID121333429
Molecular FormulaC5H9AgO4
Molecular Weight240.99 g/mol
Exact Mass239.96
IUPAC Namesilver 4-hydroxybutyl carbonate
SMILESO=C([O-])OCCCCO.[Ag+]
InChIInChI=1S/C5H10O4.Ag/c6-3-1-2-4-9-5(7)8;/h6H,1-4H2,(H,7,8);/q;+1/p-1
InChIKeyPQEWXAWDRNFBKH-UHFFFAOYSA-M
XLogP-0.88
TPSA69.59 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.99
LogP ≤ 5-0.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

dilithium;4-carboxylatooxybutyl carbonate
CID 101151816
6-aminohexyl carbonate
CID 59921398
bis(5-hydroxypentyl) carbonate
CID 54559104
6-(6-hydroxyhexoxycarbonyloxy)hexyl 6-hydroxyhexyl carbonate
CID 21031358
6-(4-hydroxybutoxy)-6-oxohexanoate
CID 22388755
hexyl carbonate;tin(4+)
CID 161248658
copper;4-hydroxybutyl acetate
CID 174883849
dodecyl carbonate;methylazanium
CID 141334888
4-hydroxybutyl N-[4-(4-hydroxybutoxycarbonylamino)butyl]carbamate
CID 175946939
5-hydroxypentyl N-methylcarbamate
CID 138694704
bis(10-hydroxydecyl) tetradecanedioate
CID 171852033
bis(7-hydroxyheptyl) icosanedioate
CID 91383667

Frequently Asked Questions

What is the IUPAC name of silver 4-hydroxybutyl carbonate?
The IUPAC name of silver 4-hydroxybutyl carbonate (CID 121333429) is silver 4-hydroxybutyl carbonate.
What is the SMILES notation for silver 4-hydroxybutyl carbonate?
The canonical SMILES for silver 4-hydroxybutyl carbonate is O=C([O-])OCCCCO.[Ag+].
What is the InChIKey of silver 4-hydroxybutyl carbonate?
The InChIKey is PQEWXAWDRNFBKH-UHFFFAOYSA-M. The full InChI is InChI=1S/C5H10O4.Ag/c6-3-1-2-4-9-5(7)8;/h6H,1-4H2,(H,7,8);/q;+1/p-1.
What are the key properties of silver 4-hydroxybutyl carbonate?
silver 4-hydroxybutyl carbonate has a molecular weight of 240.99 g/mol, XLogP of -0.88, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for silver 4-hydroxybutyl carbonate is sourced from PubChem (CID 121333429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).