2,4-Dihydroxy-5-methoxybenzaldehyde

CAT: 0024-sc-474607Size: 100 mgDry Ice: NoHazardous: No

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CAT#:0024-sc-474607Size:100 mg

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CAS Number

51061-83-7

Chemical Information

2,4-Dihydroxy-5-methoxybenzaldehyde

CAS Number	51061-83-7
PubChem CID	11194554
IUPAC Name	2,4-dihydroxy-5-methoxybenzaldehyde
Molecular Formula	C8H8O4
Molecular Weight	168.15
XLogP	1.2
Topological Polar Surface Area	66.8
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	2
Heavy Atom Count	12
Formal Charge	0
Complexity	159

SMILES

COC1=C(C=C(C(=C1)C=O)O)O

InChI

InChI=1S/C8H8O4/c1-12-8-2-5(4-9)6(10)3-7(8)11/h2-4,10-11H,1H3

InChIKey

ZFZAFNQYRZGWNK-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 51061-83-7

CID: 11194554

Formula: C8H8O4

MW: 168.15

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	168.15
XLogP3	1.2
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	2
Exact Mass	168.04225873
Monoisotopic Mass	168.04225873
Topological Polar Surface Area	66.8 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	159
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
sc-232008	3,4-Dihydroxy-5-methoxybenzaldehyde
sc-267798	4,5-Difluoro-2-methoxybenzaldehyde
sc-231124	2,5-Dimethyl-4-methoxybenzaldehyde
sc-307004	2-Bromo-4-ethoxy-5-methoxybenzaldehyde
sc-230037	2-Bromo-5-hydroxy-4-methoxybenzaldehyde
sc-307023	2-Bromo-5-ethoxy-4-methoxybenzaldehyde
sc-282960	2-bromo-4-hydroxy-5-methoxybenzaldehyde
sc-299357A	4-Acetoxy-2-bromo-5-methoxybenzaldehyde
sc-299357	4-Acetoxy-2-bromo-5-methoxybenzaldehyde
sc-230040	2-Bromo-5-methoxybenzaldehyde

Catalog	Name
274243-01	2,4-Dihydroxy-5-methoxybenzaldehyde
FD67425-01	3,4-Dihydroxy-5-methoxybenzaldehyde
230906-01	2,4-Dihydroxy-5-methoxybenzaldehyde 99+% (GC)
FD67774-01	2,3-Dihydroxy-4-methoxybenzaldehyde
ICA92229-01	2,4-Dihydroxy-3-methoxybenzaldehyde
D29652-01	3,4-Dihydroxy-5-methoxybenzaldehyde 95%
D29649-01	2,3-Dihydroxy-4-methoxybenzaldehyde 95%
OR1097454-01	4,5-dibromo-2-methoxybenzaldehyde
PC1122-01	4,5-Difluoro-2-methoxybenzaldehyde
OR55242-01	2,4-Dibromo-5-methoxybenzaldehyde