2-iodo-3-methoxybenzaldehyde

CAT: 0127-OR1098472-01Size: 250 mgDry Ice: NoHazardous: No

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CAT#:0127-OR1098472-01Size:250 mg

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CAS Number

70738-03-3

MDL Number

MFCD09834662

Purity

97%

Smiles

C1 (cccc (c1I) OC) C=O

Chemical Information

2-Iodo-3-methoxybenzaldehyde

CAS Number	70738-03-3
PubChem CID	12490490
IUPAC Name	2-iodo-3-methoxybenzaldehyde
Molecular Formula	C8H7IO2
Molecular Weight	262.04
XLogP	2
Topological Polar Surface Area	26.3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Heavy Atom Count	11
Formal Charge	0
Complexity	138

SMILES

COC1=CC=CC(=C1I)C=O

InChI

InChI=1S/C8H7IO2/c1-11-7-4-2-3-6(5-10)8(7)9/h2-5H,1H3

InChIKey

QZQLZRSMGYUBKN-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 70738-03-3

CID: 12490490

Formula: C8H7IO2

MW: 262.04

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	262.04
XLogP3	2
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Exact Mass	261.94908
Monoisotopic Mass	261.94908
Topological Polar Surface Area	26.3 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	138
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
OR401040	3-Iodo-2-methoxybenzaldehyde
OR401047-01	4-Iodo-2-methoxybenzaldehyde
OR1084374-01	3-Iodo-5-methoxybenzaldehyde
OR400628-01	4-Iodo-3-methoxybenzaldehyde
OR400057-01	5-Iodo-2-methoxybenzaldehyde
OR400144	2-Iodo-6-methoxybenzaldehyde
OR62152-01	2-Iodo-5-methoxybenzaldehyde
OR400626-01	2-Iodo-4-methoxybenzaldehyde
OR63027-01	3-Iodo-4-methoxybenzaldehyde
PC1014253-01	2-Fluoro-3-iodo-6-methoxybenzaldehyde

Catalog	Name
FEA46913-01	2-Iodo-4-methoxybenzaldehyde
FAA02559-01	2-Iodo-6-methoxybenzaldehyde
CDA28758	2-Iodo-5-methoxybenzaldehyde
AN EU 2966-01	3-iodo-4-methoxybenzaldehyde
sc-226085	3-Hydroxy-2-iodo-4-methoxybenzaldehyde
FH70345-01	2-Hydroxy-5-iodo-3-methoxybenzaldehyde
HDA58397-01	4-Benzyloxy-2-iodo-5-methoxybenzaldehyde
DIB29977-01	4- (Cyclopentyloxy) -3-iodo-5-methoxybenzaldehyde
VNA98563-01	4-[ (2-Chlorobenzyl) oxy]-3-iodo-5-methoxybenzaldehyde
DSA48380-01	3-Ethoxy-5-iodo-4-methoxybenzaldehyde