Methyl 5-methylpicolinate

HCID 268759
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Basic information

CAS
29681-38-7
Standard SMILES
COC(=O)c1ccc(C)cn1
InChIKey
GLXLMXAFURBIEZ-UHFFFAOYSA-N
Molecular formula
C8H9NO2
Average molar mass
151.16 g/mol
Monoisotopic mass
151.06332853

Names & identifiers

Preferred name
Methyl 5-methylpicolinate
IUPAC
methyl 5-methylpyridine-2-carboxylate
English name
2-Pyridinecarboxylicacid,5-methyl-,methylester(9CI)
Molecular formula
C8H9NO2
Molecular weight
151.16

Names & synonyms

Methyl 5-methylpicolinate29681-38-7DTXSID80296409RefChem:1089493DTXCID30247547methyl 5-methylpyridine-2-carboxylate5-METHYLPYRIDINE-2-CARBOXYLIC ACID METHYL ESTERMFCD110406482-Pyridinecarboxylic acid, 5-methyl-, methyl estermethyl5-methylpicolinateNSC109152SCHEMBL82621
Show more names
NSC 1091525-Methyl-,Methylester(9CI)5-Methylpicolic acid Methyl ester5-Methylpicolinic acid methyl esterMethyl 5-methylpyridine-2-carboxylate 98%5-methyl-2-pyridinecarboxylic acid methyl ester
CS-W006118NSC-109152SY0465502-Pyridinecarboxylicacid,5-methyl-,methylester(9CI)Methyl 5-methyl-2Methyl 5-methyl-2-pyridinecarboxylate260998-85-4AM803652

Database identifiers

CAS
29681-38-7
PubChem CID
268759
DTXSID
DTXSID80296409
Nikkaji
J1.051.320K

Properties

Computed structural properties

XLogP
0.7
Topological polar surface area
39.2 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
2
Heavy atoms
11

Physicochemical properties

Melting point
54 · 54-55℃
Boiling point
253 ℃ · 253℃
Density
1.104 · 1.104
Flash point
107 ℃ · 107℃
storage temp.
Sealed in dry,Room Temperature
form
solid

Safety & regulation

Safety data

hs_code
2933399990
Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H302-H315-H319
Precautionary statements
P501-P270-P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313-P301+P312+P330

Chemistry & industry

Upstream & downstream products

Suppliers80 total

上海凌富药物研究有限公司+86(21)5895 0110 19945755304 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
常州科化生物科技有限公司0519-68985668 13685222090 · [email protected]

Related reactions

4 records
New reaction record

Compound notes

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