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Benzoic acid

CAT: 1410-M15503-02Size: 1 mL x 10 mM in DMSODry Ice: NoHazardous: No
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CAT#:1410-M15503-02Size:1 mL x 10 mM in DMSO
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Description
Benzoic acid is a Nitrogen Binding Agent. The mechanism of action of benzoic acid is as an Ammonium Ion Binding Activity.
CAS Number
65-85-0
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
122.12
Molecular Formula
C7H6O2
Notes
Research use only, not for human use.
Receptor
Others

Chemical Information

Benzoic Acid

Benzoic acid is a compound comprising a benzene ring core carrying a carboxylic acid substituent. It has a role as an EC 1.13.11.33 (arachidonate 15-lipoxygenase) inhibitor, an EC 3.1.1.3 (triacylglycerol lipase) inhibitor, an antimicrobial food preservative, a plant metabolite, a human xenobiotic metabolite, an algal metabolite and a drug allergen. It is a conjugate acid of a benzoate.

CAS Number65-85-0
PubChem CID243
IUPAC Namebenzoic acid
Molecular FormulaC7H6O2
Molecular Weight122.12
XLogP1.9
Topological Polar Surface Area37.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Heavy Atom Count9
Formal Charge0
Complexity103
SMILES
C1=CC=C(C=C1)C(=O)O
InChI
InChI=1S/C7H6O2/c8-7(9)6-4-2-1-3-5-6/h1-5H,(H,8,9)
InChIKey
WPYMKLBDIGXBTP-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Benzoic Acid
CAS: 65-85-0
CID: 243
Formula: C7H6O2
MW: 122.12
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight122.12
XLogP31.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Exact Mass122.036779430
Monoisotopic Mass122.036779430
Topological Polar Surface Area37.3 Ų
Heavy Atom Count9
Formal Charge0
Complexity103
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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