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3,5-Dihydroxybenzaldehyde

CAT: 0804-HY-W007416-01Size: 1 gDry Ice: NoHazardous: No
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CAT#:0804-HY-W007416-01Size:1 g
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Description
3,5-Dihydroxybenzaldehyde is a dihydroxy benzaldehyde[1].
CAS Number
26153-38-8
UNSPSC
12352005
Hazard Statement
H302, H315, H319, H335
Target
Biochemical Assay Reagents
Type
Reference compound
Related Pathways
Others
Field of Research
Others
Assay Protocol
https://www.medchemexpress.com/3-5-dihydroxybenzaldehyde.html
Purity
99.90
Solubility
DMSO : 100 mg/mL (ultrasonic)
Smiles
O=CC1=CC(O)=CC(O)=C1
Molecular Formula
C7H6O3
Molecular Weight
138.12
Precautions
H302, H315, H319, H335
References & Citations
[1]M. Sahin, et al. Bis-Schiff Base Derivatives of 2,5- Dihydroxybenzaldehyde: Synthesis, Characterization and Antimicrobial Activity of Their Cu (II), Co (II) and Zn (II) Complexes. Journal of Macromolecular Science, Part A: Pure and Applied Chemistry. 30 December 2014, At: 12:22.
Shipping Conditions
Room Temperature
Storage Conditions
4°C (Powder, stored under nitrogen)
Scientific Category
Reference compound1
Clinical Information
No Development Reported

Chemical Information

3,5-Dihydroxybenzaldehyde

3,5-dihydroxybenzaldehyde is a dihydroxybenzaldehyde.

CAS Number26153-38-8
PubChem CID94365
IUPAC Name3,5-dihydroxybenzaldehyde
Molecular FormulaC7H6O3
Molecular Weight138.12
XLogP0.7
Topological Polar Surface Area57.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Heavy Atom Count10
Formal Charge0
Complexity114
SMILES
C1=C(C=C(C=C1O)O)C=O
InChI
InChI=1S/C7H6O3/c8-4-5-1-6(9)3-7(10)2-5/h1-4,9-10H
InChIKey
HAQLHRYUDBKTJG-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 3,5-Dihydroxybenzaldehyde
CAS: 26153-38-8
CID: 94365
Formula: C7H6O3
MW: 138.12
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight138.12
XLogP30.7
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Exact Mass138.031694049
Monoisotopic Mass138.031694049
Topological Polar Surface Area57.5 Ų
Heavy Atom Count10
Formal Charge0
Complexity114
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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