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Acetic Acid - Substance Summary (SID 3335)

Product of the oxidation of ethanol and of the destructive distillation of wood. It is used locally, occasionally internally, as a counterirritant and also as a reagent. (Stedman, 26th ed)


Drug and Chemical Information: (Total:1)         

Medication Information

Each 100 mL contains:Glacial Acetic Acid USP 0.25 gWater for Injection USP qspH: 3.1 (2.83.4)Calculated Osmolarity: 42 mOsmol/liter The formula of the active ingredient is:Ingredient Molecular Fo
DescriptionClinical PharmacologyIndication & Usage
ContraindicationsWarningsPrecautions
Adverse ReactionsOverdosageDosage & Administration
How SuppliedSupplemental Patient Material







Pharmacological Action

Indicators and Reagents - Substances used for the detection, identification, analysis, etc. of chemical, biological, or pathologic processes or conditions. ...


  Pharmacological Classification
Chemical Actions and Uses
      Specialty Uses of Chemicals
            Laboratory Chemicals
                  Indicators and Reagents


  Chemical Classification
Lipids
      Fatty Acids
            Fatty Acids, Volatile
                  Acetic Acids
                        Acetic Acid
Organic Chemicals
      Carboxylic Acids
            Acids, Acyclic
                  Acetic Acids
                        Acetic Acid


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Data Source:   

Depositor: KEGG
External ID: C00033

Depositor-Supplied Synonyms: (Total: 6)
Sort:
acetic acid
ethanoic acid
Glacial acetic acid
acetate
C00033
64-19-7


Properties Computed from Structure:
Molecular Weight60.05196 [g/mol]
Molecular FormulaC2H4O2
XLogP3-AA-0.2
H-Bond Donor1
H-Bond Acceptor2
Rotatable Bond Count0
Exact Mass60.021129
MonoIsotopic Mass60.021129
Topological Polar Surface Area37.3
Heavy Atom Count4
Formal Charge0
Complexity31
Isotope Atom Count0
Defined Atom StereoCenter Count0
Undefined Atom StereoCenter Count0
Defined Bond StereoCenter Count0
Undefined Bond StereoCenter Count0
Covalently-Bonded Unit Count1


Descriptors Computed from Structure:
IUPAC Name: acetic acid
Canonical SMILES: CC(=O)O
InChI: InChI=1S/C2H4O2/c1-2(3)4/h1H3,(H,3,4)
InChIKey: QTBSBXVTEAMEQO-UHFFFAOYSA-N


Substance Information:
SID 3335   
Deposit Date: 2005-06-24
Modify Date: 2008-09-10

CID 176   
Create Date: 2004-09-16

Related Substances:
Same: 1678 Links
Same, Connectivity: 1739 Links

Similar Substances: 1850 Links


Depositor-Supplied Comments:
CAS: 64-19-7
ChEBI: 15366
LIPIDMAPS: LMFA01010002
LipidBank: DFA0002
KNApSAcK: C00001176
PDB-CCD: ACY
3DMET: B00009
Same as: D00010
Is a reactant or product of enzyme EC 1.2.1.3
Is a reactant or product of enzyme EC 1.2.1.5
Is a reactant or product of enzyme EC 1.2.2.2
Is a reactant or product of enzyme EC 1.2.99.3
Is a reactant or product of enzyme EC 1.2.99.6
Is a reactant or product of enzyme EC 1.13.11.50
Is a reactant or product of enzyme EC 1.13.12.4
Is a reactant or product of enzyme EC 1.14.13.54
Is a reactant or product of enzyme EC 2.1.1.152
Is a reactant or product of enzyme EC 2.5.1.47
Is a reactant or product of enzyme EC 2.5.1.48
Is a reactant or product of enzyme EC 2.5.1.49
Is a reactant or product of enzyme EC 2.5.1.50
Is a reactant or product of enzyme EC 2.5.1.51
Is a reactant or product of enzyme EC 2.5.1.52
Is a reactant or product of enzyme EC 2.5.1.53
Is a reactant or product of enzyme EC 2.5.1.65
Is a reactant or product of enzyme EC 2.7.1.86
Is a reactant or product of enzyme EC 2.7.2.1
Is a reactant or product of enzyme EC 2.7.2.12
Is a reactant or product of enzyme EC 2.7.2.15
Is a reactant or product of enzyme EC 2.8.3.1
Is a reactant or product of enzyme EC 2.8.3.3
Is a reactant or product of enzyme EC 2.8.3.8
Is a reactant or product of enzyme EC 2.8.3.10
Is a reactant or product of enzyme EC 2.8.3.11
Is a reactant or product of enzyme EC 2.8.3.12
Is a reactant or product of enzyme EC 2.8.3.14
Is a reactant or product of enzyme EC 3.1.1.2
Is a reactant or product of enzyme EC 3.1.1.6
Is a reactant or product of enzyme EC 3.1.1.7
Is a reactant or product of enzyme EC 3.1.1.33
Is a reactant or product of enzyme EC 3.1.1.41
Is a reactant or product of enzyme EC 3.1.1.47
Is a reactant or product of enzyme EC 3.1.1.53
Is a reactant or product of enzyme EC 3.1.1.54
Is a reactant or product of enzyme EC 3.1.1.55
Is a reactant or product of enzyme EC 3.1.1.56
Is a reactant or product of enzyme EC 3.1.1.58
Is a reactant or product of enzyme EC 3.1.1.66
Is a reactant or product of enzyme EC 3.1.1.71
Is a reactant or product of enzyme EC 3.1.1.80
Is a reactant or product of enzyme EC 3.1.2.1
Is a reactant or product of enzyme EC 3.1.2.16
Is a reactant or product of enzyme EC 3.5.1.4
Is a reactant or product of enzyme EC 3.5.1.14
Is a reactant or product of enzyme EC 3.5.1.15
Is a reactant or product of enzyme EC 3.5.1.16
Is a reactant or product of enzyme EC 3.5.1.17
Is a reactant or product of enzyme EC 3.5.1.21
Is a reactant or product of enzyme EC 3.5.1.25
Is a reactant or product of enzyme EC 3.5.1.29
Is a reactant or product of enzyme EC 3.5.1.33
Is a reactant or product of enzyme EC 3.5.1.41
Is a reactant or product of enzyme EC 3.5.1.47
Is a reactant or product of enzyme EC 3.5.1.48
Is a reactant or product of enzyme EC 3.5.1.51
Is a reactant or product of enzyme EC 3.5.1.62
Is a reactant or product of enzyme EC 3.5.1.63
Is a reactant or product of enzyme EC 3.5.1.66
Is a reactant or product of enzyme EC 3.5.1.76
Is a reactant or product of enzyme EC 3.5.1.85
Is a reactant or product of enzyme EC 3.5.1.89
Is a reactant or product of enzyme EC 3.5.1.-
Is a reactant or product of enzyme EC 3.6.1.7
Is a reactant or product of enzyme EC 3.6.1.20
Is a reactant or product of enzyme EC 3.7.1.1
Is a reactant or product of enzyme EC 3.7.1.6
Is a reactant or product of enzyme EC 3.7.1.-
Is a reactant or product of enzyme EC 3.11.1.2
Is a reactant or product of enzyme EC 4.1.2.30
Is a reactant or product of enzyme EC 4.1.3.6
Is a reactant or product of enzyme EC 4.1.3.22
Is a reactant or product of enzyme EC 4.1.3.26
Is a reactant or product of enzyme EC 6.2.1.1
Is a reactant or product of enzyme EC 6.2.1.13
Is a reactant or product of enzyme EC 6.2.1.22

     
Compound Displayed

2D

3D

Compound ID176
Molecular Weight60.05196 [g/mol]
Molecular FormulaC2H4O2
XLogP3-AA-0.2
H-Bond Donor1
H-Bond Acceptor2


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