2-Hydroxy-6-methoxy-4-methylbenzaldehyde

CAT: 0127-OR1031103-01Size: 100 mgDry Ice: NoHazardous: No

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CAT#:0127-OR1031103-01Size:100 mg

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CAS Number

39503-23-6

Purity

97%

Smiles

O=CC1=C(C=C(C)C=C1OC)O

Chemical Information

2-Hydroxy-6-methoxy-4-methylbenzaldehyde

CAS Number	39503-23-6
PubChem CID	285925
IUPAC Name	2-hydroxy-6-methoxy-4-methylbenzaldehyde
Molecular Formula	C9H10O3
Molecular Weight	166.17
XLogP	1.9
Topological Polar Surface Area	46.5
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	2
Heavy Atom Count	12
Formal Charge	0
Complexity	158

SMILES

CC1=CC(=C(C(=C1)OC)C=O)O

InChI

InChI=1S/C9H10O3/c1-6-3-8(11)7(5-10)9(4-6)12-2/h3-5,11H,1-2H3

InChIKey

HEAFAVIWDSGTMD-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 39503-23-6

CID: 285925

Formula: C9H10O3

MW: 166.17

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	166.17
XLogP3	1.9
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	2
Exact Mass	166.062994177
Monoisotopic Mass	166.062994177
Topological Polar Surface Area	46.5 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	158
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
OR1031185-01	2-Hydroxy-4-methoxy-5-methylbenzaldehyde
OR97109-01	2-Hydroxy-4-methoxy-3-methylbenzaldehyde
OR18418-01	2-Methoxy-6-methylbenzaldehyde
OR1082375	2-Bromo-6-methoxy-4-methylbenzaldehyde
OR1088474-01	2-bromo-4-methoxy-6-methylbenzaldehyde
OR1099001	4-Bromo-2-methoxy-6-methylbenzaldehyde
PC1025573	2-Fluoro-6-methoxy-4-methylbenzaldehyde
OR1085579-01	2-chloro-6-methoxy-4-methylbenzaldehyde
OR1088507	2-Chloro-4-methoxy-6-methylbenzaldehyde
OR938926-01	2-Hydroxy-6-methylbenzaldehyde

Catalog	Name
B208355	6-Benzoyloxy-2-hydroxy-4-methoxy-3-methylbenzaldehyde
ZCA51654-01	2-Hydroxy-5-methoxy-4-methylbenzaldehyde
HAA72161-01	5-Hydroxy-4-methoxy-2-methylbenzaldehyde
TAA10232-01	4-Hydroxy-3-methoxy-2-methylbenzaldehyde
418609-01	2-Methoxy-6-methylbenzaldehyde
MEC29577-01	2-Fluoro-6-methoxy-4-methylbenzaldehyde
CHC39637-01	2-Chloro-6-hydroxy-4-methylbenzaldehyde
AR-B06350-01	4-Hydroxy-3-methoxy-5-methylbenzaldehyde
418577-01	2-Methoxy-4-methylbenzaldehyde
sc-232810	4-Methoxy-2-methylbenzaldehyde