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3-Ethylsalicylaldehyde

CAT: 0572-TRC-E918795-1GSize: 1 gDry Ice: NoHazardous: No
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CAT#:0572-TRC-E918795-1GSize:1 g
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
73289-91-5
Synonyms
3-Ethyl-2-hydroxybenzaldehyde; 3-Ethylsalicylaldehyde; 3-Ethyl-2-hydroxybenzaldehyde;
Hazard Statement
No Data Available
Smiles
CCc1cccc(C=O)c1O
Molecular Formula
C9H10O2
Molecular Weight
150.17
Shipping Conditions
Room Temperature
Storage Conditions
+4°C

Chemical Information

3-Ethyl-2-hydroxybenzaldehyde
CAS Number73289-91-5
PubChem CID10125073
IUPAC Name3-ethyl-2-hydroxybenzaldehyde
Molecular FormulaC9H10O2
Molecular Weight150.17
XLogP2.4
Topological Polar Surface Area37.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Heavy Atom Count11
Formal Charge0
Complexity134
SMILES
CCC1=C(C(=CC=C1)C=O)O
InChI
InChI=1S/C9H10O2/c1-2-7-4-3-5-8(6-10)9(7)11/h3-6,11H,2H2,1H3
InChIKey
GEAPDYBQINBSRA-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 3-Ethyl-2-hydroxybenzaldehyde
CAS: 73289-91-5
CID: 10125073
Formula: C9H10O2
MW: 150.17
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight150.17
XLogP32.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Exact Mass150.068079557
Monoisotopic Mass150.068079557
Topological Polar Surface Area37.3 Ų
Heavy Atom Count11
Formal Charge0
Complexity134
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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