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3-Bromo-4-hydroxybenzaldehyde

CAT: 0572-TRC-B415380-25GSize: 25 gDry Ice: NoHazardous: No
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CAT#:0572-TRC-B415380-25GSize:25 g
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
2973-78-6
Synonyms
2-Bromo-4-formylphenol; 4-Hydroxy-3-bromobenzaldehyde; NSC 220227
Hazard Statement
No Data Available
Purity
>95% (HPLC)
Smiles
Oc1ccc(C=O)cc1Br
Molecular Formula
C7H5BrO2
Molecular Weight
201.02
Shipping Conditions
Room Temperature
Storage Conditions
-20°C

Chemical Information

3-Bromo-4-hydroxybenzaldehyde

3-Bromo-4-hydroxybenzaldehyde has been reported in Pseudoceratina purpurea with data available.

CAS Number2973-78-6
PubChem CID76308
IUPAC Name3-bromo-4-hydroxybenzaldehyde
Molecular FormulaC7H5BrO2
Molecular Weight201.02
XLogP2
Topological Polar Surface Area37.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Heavy Atom Count10
Formal Charge0
Complexity127
SMILES
C1=CC(=C(C=C1C=O)Br)O
InChI
InChI=1S/C7H5BrO2/c8-6-3-5(4-9)1-2-7(6)10/h1-4,10H
InChIKey
UOTMHAOCAJROQF-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 3-Bromo-4-hydroxybenzaldehyde
CAS: 2973-78-6
CID: 76308
Formula: C7H5BrO2
MW: 201.02
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight201.02
XLogP32
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Exact Mass199.94729
Monoisotopic Mass199.94729
Topological Polar Surface Area37.3 Ų
Heavy Atom Count10
Formal Charge0
Complexity127
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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CatalogName
FB30014-013-Bromo-4-hydroxybenzaldehyde
OR907915-014-Bromo-3-hydroxybenzaldehyde
FB11113-014-Bromo-2-hydroxybenzaldehyde
OR75071-012-Bromo-4-hydroxybenzaldehyde
sc-260798A3-Bromo-5-ethoxy-4-hydroxybenzaldehyde
PC10240942-bromo-4-fluoro-3-hydroxybenzaldehyde
PC905038-013-Bromo-5-fluoro-4-hydroxybenzaldehyde
BAA849763-Bromo-5-chloro-4-hydroxybenzaldehyde
OR1057105-013-Bromo-4-chloro-5-hydroxybenzaldehyde
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