3-Chloro-2-methoxyisonicotinaldehyde

CAT: 0127-OR1036839Size: 250 mgDry Ice: NoHazardous: No

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CAT#:0127-OR1036839Size:250 mg

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CAS Number

885167-89-5

MDL Number

MFCD08277303

Purity

98%

Smiles

ClC1=C(C=CN=C1OC)C=O

Chemical Information

3-Chloro-2-methoxypyridine-4-carbaldehyde

CAS Number	885167-89-5
PubChem CID	44754885
IUPAC Name	3-chloro-2-methoxypyridine-4-carbaldehyde
Molecular Formula	C7H6ClNO2
Molecular Weight	171.58
XLogP	1.2
Topological Polar Surface Area	39.2
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	2
Heavy Atom Count	11
Formal Charge	0
Complexity	142

SMILES

COC1=NC=CC(=C1Cl)C=O

InChI

InChI=1S/C7H6ClNO2/c1-11-7-6(8)5(4-10)2-3-9-7/h2-4H,1H3

InChIKey

AFHJJQSJJLRSNR-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 885167-89-5

CID: 44754885

Formula: C7H6ClNO2

MW: 171.58

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	171.58
XLogP3	1.2
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	2
Exact Mass	171.0087061
Monoisotopic Mass	171.0087061
Topological Polar Surface Area	39.2 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	142
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
OR1069183-01	2-Chloro-5-methoxyisonicotinaldehyde
OR83795-01	5-Chloro-2-methoxyisonicotinaldehyde
OR61392-01	2-Chloro-6-methoxyisonicotinaldehyde
PC1018280-01	5-Chloro-3-fluoro-2-methoxyisonicotinaldehyde
OR46110-01	2-Methoxyisonicotinaldehyde
OR74542-01	3-Methoxyisonicotinaldehyde
OR1071818-01	2-Bromo-3-methoxyisonicotinaldehyde
OR1096587-01	3-bromo-2-methoxyisonicotinaldehyde
PC1009538	2-fluoro-3-methoxyisonicotinaldehyde
OR1086376-01	3,5-Dichloro-2-methoxyisonicotinaldehyde

Catalog	Name
KKB16789-01	3-Chloro-2-methoxyisonicotinaldehyde
sc-506973	2-Methoxyisonicotinaldehyde
426310-01	3-Methoxyisonicotinaldehyde
sc-265521	2-Chloro-2- (3-chloro-phenyl) -ethanol
sc-312843	3-Chloro-N- (2-chloro-3-pyridinyl) -2,2-dimethylpropanamide
C20150	3-Chloro-2,2,3-trimethylbutane
sc-307591	2-Chloro-N- (3-chloro-2-fluorophenyl) acetamide
TRC-C365480-100MG	2-Chloro-N-(3-chloro-2-methylphenyl)nicotinamide
AR-P01756-01	2-chloro-3- (2-chloro-1-hydroxyethyl) phenol
BAA01871-01	3-Chloro-4- (3-chloro-2-nitrophenyl) pyrrole