Methyl 2-hydroxy-6-methylisonicotinate

CAT: 0127-OR30788-01Size: 250 mgDry Ice: NoHazardous: No

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CAT#:0127-OR30788-01Size:250 mg

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CAS Number

98491-78-2

Synonyms

Methyl 2-hydroxy-6-methylpyridine-4-carboxylate, 2-Hydroxy-4- (methoxycarbonyl) -6-methylpyridine

MDL Number

MFCD13188667

Purity

95%

Smiles

COC(=O)c1cc(C)nc(O)c1

Storage Conditions

Store at 2-8°C

Chemical Information

Methyl 2-hydroxy-6-methylisonicotinate

CAS Number	98491-78-2
PubChem CID	14117784
IUPAC Name	methyl 2-methyl-6-oxo-1H-pyridine-4-carboxylate
Molecular Formula	C8H9NO3
Molecular Weight	167.16
XLogP	0.2
Topological Polar Surface Area	55.4
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	2
Heavy Atom Count	12
Formal Charge	0
Complexity	289

SMILES

CC1=CC(=CC(=O)N1)C(=O)OC

InChI

InChI=1S/C8H9NO3/c1-5-3-6(8(11)12-2)4-7(10)9-5/h3-4H,1-2H3,(H,9,10)

InChIKey

UAWGJLZPZYXSBO-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 98491-78-2

CID: 14117784

Formula: C8H9NO3

MW: 167.16

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	167.16
XLogP3	0.2
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	2
Exact Mass	167.058243149
Monoisotopic Mass	167.058243149
Topological Polar Surface Area	55.4 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	289
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
OR1051898-01	Ethyl 2-hydroxy-6-methylisonicotinate
OR8630-01	Methyl 2-chloro-6-methylisonicotinate
OR82060-01	Methyl 2-amino-6-methylisonicotinate
OR313085-01	Methyl 2-bromo-6-methylisonicotinate
OR954067-01	Methyl 2-methylisonicotinate
OR27078	Ethyl 3-cyano-2-hydroxy-6-methylisonicotinate
OR1046131-01	Methyl 2,6-dichloro-3-methylisonicotinate
OR1070241-01	Ethyl 5-hydroxy-2-methylisonicotinate
OR1052497-01	Methyl 2- ((tert-butoxycarbonyl) amino) -6-methylisonicotinate
OR1004577	Methyl 2-chloro-6-iodo-3-methylisonicotinate

Catalog	Name
454968-01	Methyl 2-hydroxy-6-methylisonicotinate
JKB49471	Methyl 2-bromo-6-methylisonicotinate
454908-01	Methyl 2-Chloro-6-methylisonicotinate
AFA84996-01	Methyl 2,6-dichloro-3-methylisonicotinate
EXC40676-01	Methyl 5-bromo-2-methylisonicotinate
MGB59641	Methyl 2-chloro-3-methylisonicotinate
AL BF 1501-01	Methyl 2-hydroxy-6-methoxybenzoate
418298-01	2-Hydroxy-6-methyl-benzonitrile
TRC-H947945-100MG	6-Hydroxy-2-methyl Isoborneol
AR-M03067-01	Methyl 2-Hydroxy-6-Methylbenzoate