3-Chloro-2-ethoxybenzaldehyde

CAT: 0926-JDB64970-01Size: 0.5 gDry Ice: NoHazardous: No

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CAT#:0926-JDB64970-01Size:0.5 g

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CAS Number

709649-70-7

MDL Number

MFCD24678078

Smiles

CCOC1=C (C=CC=C1Cl) C=O

Molecular Formula

C9H9ClO2

Molecular Weight

184.62 g/mol

Controlled

Chemical Information

3-Chloro-2-ethoxybenzaldehyde

CAS Number	709649-70-7
PubChem CID	59456922
IUPAC Name	3-chloro-2-ethoxybenzaldehyde
Molecular Formula	C9H9ClO2
Molecular Weight	184.62
XLogP	2.3
Topological Polar Surface Area	26.3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	3
Heavy Atom Count	12
Formal Charge	0
Complexity	149

SMILES

CCOC1=C(C=CC=C1Cl)C=O

InChI

InChI=1S/C9H9ClO2/c1-2-12-9-7(6-11)4-3-5-8(9)10/h3-6H,2H2,1H3

InChIKey

CRKCZHSKXMXWSB-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 709649-70-7

CID: 59456922

Formula: C9H9ClO2

MW: 184.62

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	184.62
XLogP3	2.3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	3
Exact Mass	184.0291072
Monoisotopic Mass	184.0291072
Topological Polar Surface Area	26.3 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	149
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
VJA36831-01	2-Chloro-4-ethoxybenzaldehyde
SCB27964-01	4- (Benzyloxy) -2-chloro-5-ethoxybenzaldehyde
TSA29194	4- (Allyloxy) -3-chloro-5-ethoxybenzaldehyde
DSA49285-01	3-Chloro-4-[ (2-chlorobenzyl) oxy]-5-ethoxybenzaldehyde
FE35040-01	2-Ethoxybenzaldehyde
SCB26105-01	2-Chloro-4-[ (2-chlorobenzyl) oxy]-5-ethoxybenzaldehyde
LCA65767	3,5-Dibromo-2-ethoxybenzaldehyde
LBC42998-01	4-[2- (3-Chlorophenoxy) ethoxy]-3-ethoxybenzaldehyde
FB137976-01	5-Bromo-2-ethoxybenzaldehyde
TBA19232	2-Bromo-5-ethoxybenzaldehyde

Catalog	Name
OR1070487-01	3-Chloro-2-ethoxybenzaldehyde
sc-284586	5-chloro-2-ethoxybenzaldehyde
OR1094465	4-Chloro-2-ethoxybenzaldehyde
OR1089347-01	3-chloro-5-ethoxybenzaldehyde
OR929320-01	3-Chloro-4-ethoxybenzaldehyde
OR1080024-01	2-Chloro-6-ethoxybenzaldehyde
OR957063	2-Chloro-4-ethoxybenzaldehyde
OR1083372-01	2-chloro-5-ethoxybenzaldehyde
OR1099910	4-Chloro-3-ethoxybenzaldehyde
OR1088496-01	3-bromo-2-chloro-5-ethoxybenzaldehyde