perchloric acid;triethyl(methyl)azanium

C7H19ClNO4+ — CID 87764447

IUPACperchloric acid;triethyl(methyl)azanium
SMILESCC[N+](C)(CC)CC.[O-][Cl+3]([O-])([O-])O
InChIInChI=1S/C7H18N.ClHO4/c1-5-8(4,6-2)7-3;2-1(3,4)5/h5-7H2,1-4H3;(H,2,3,4,5)/q+1;
InChIKeyBLRMUYHDGZLDLY-UHFFFAOYSA-N
MW216.68 g/mol
LogP-2.63
Rot. Bonds3

About perchloric acid;triethyl(methyl)azanium

perchloric acid;triethyl(methyl)azanium (PubChem CID 87764447) has the molecular formula C7H19ClNO4+ and a molecular weight of 216.68 g/mol. Its IUPAC name is perchloric acid;triethyl(methyl)azanium.

Molecular Properties

Compound Nameperchloric acid;triethyl(methyl)azanium
PubChem CID87764447
Molecular FormulaC7H19ClNO4+
Molecular Weight216.68 g/mol
Exact Mass216.10
IUPAC Nameperchloric acid;triethyl(methyl)azanium
SMILESCC[N+](C)(CC)CC.[O-][Cl+3]([O-])([O-])O
InChIInChI=1S/C7H18N.ClHO4/c1-5-8(4,6-2)7-3;2-1(3,4)5/h5-7H2,1-4H3;(H,2,3,4,5)/q+1;
InChIKeyBLRMUYHDGZLDLY-UHFFFAOYSA-N
XLogP-2.63
TPSA89.41 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.68
LogP ≤ 5-2.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'quaternary_nitrogen_2', 'substructure': 'N/A'}

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Related Compounds

triethyl(methyl)azanium iodate
CID 158535675
(Z)-but-2-enedioate;bis(triethyl(methyl)azanium)
CID 86743662
methanesulfonic acid;triethyl(methyl)azanium
CID 87743130
hydron;triethyl(methyl)azanium;tetrafluoroborate
CID 87302670
(Z)-but-2-enedioic acid;triethyl(methyl)azanium
CID 87389837
2,2-dichloropropanedioate;bis(triethyl(methyl)azanium)
CID 175220042
perchloric acid;trimethyl(octadecyl)azanium
CID 87344309
bromo(trichloro)boranuide;triethyl(methyl)azanium
CID 140836548
bromo(trifluoro)boranuide;triethyl(methyl)azanium
CID 140836561
ethyl-hydroxy-methyl-phosphanylazanium
CID 174821484
2-hydroxypropyl(trimethyl)azanium;perchloric acid
CID 87344465
nickel;perchloric acid
CID 131873014

Frequently Asked Questions

What is the IUPAC name of perchloric acid;triethyl(methyl)azanium?
The IUPAC name of perchloric acid;triethyl(methyl)azanium (CID 87764447) is perchloric acid;triethyl(methyl)azanium.
What is the SMILES notation for perchloric acid;triethyl(methyl)azanium?
The canonical SMILES for perchloric acid;triethyl(methyl)azanium is CC[N+](C)(CC)CC.[O-][Cl+3]([O-])([O-])O.
What is the InChIKey of perchloric acid;triethyl(methyl)azanium?
The InChIKey is BLRMUYHDGZLDLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H18N.ClHO4/c1-5-8(4,6-2)7-3;2-1(3,4)5/h5-7H2,1-4H3;(H,2,3,4,5)/q+1;.
What are the key properties of perchloric acid;triethyl(methyl)azanium?
perchloric acid;triethyl(methyl)azanium has a molecular weight of 216.68 g/mol, XLogP of -2.63, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for perchloric acid;triethyl(methyl)azanium is sourced from PubChem (CID 87764447), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).