AG00379P

39998-25-9 | Methyl pyridine-3-acetate

AG00379P

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CAS Number	39998-25-9
Catalog Number	AG00379P(AGN-PC-0JM1XB)
Chemical Name	Methyl pyridine-3-acetate
EC Number	254-739-0
IUPAC Name	methyl 2-pyridin-3-ylacetate
InChI	InChI=1S/C8H9NO2/c1-11-8(10)5-7-3-2-4-9-6-7/h2-4,6H,5H2,1H3
InChI Key	PZXIEBDIPWIRGB-UHFFFAOYSA-N
MDL Number	MFCD00023617
Molecular Formula	C8H9NO2
Molecular Weight	151.1626
NSC Number	75852
SMILES	N1=CC(=CC=C1)CC(=O)OC
Synonyms	39998-25-9, Methyl 2-(pyridin-3-yl)acetate, Methyl pyridine-3-acetate, Methyl 3-pyridineacetate, METHYL 3-PYRIDYLACETATE, PYRIDIN-3-YL-ACETIC ACID METHYL ESTER, 3-Pyridineacetic acid, methyl ester, Methyl 3-pyridinylacetate, methyl 2-pyridin-3-ylacetate, Methyl 2-(3-Pyridyl)acetate, 3-Pyridineacetic acid,methyl ester, EINECS 254-739-0, PubChem13725, AC1L3WJF, AC1Q5ZUR, Methyl2-(3-Pyridyl)acetate, SCHEMBL178130, methyl 2-pyridin-3-ylethanoate, CTK4I2231, KS-00000BVR, DTXSID10193053, PZXIEBDIPWIRGB-UHFFFAOYSA-N, ZINC393945, AC1Q4410, BCP28320, NSC75852, ANW-63068, MFCD00023617, NSC-75852, AKOS006275346, MCULE-9597158185, PB30559, QC-1854, VZ36308, 2-(3-pyridinyl)acetic acid methyl ester, 3-PYRIDINEACETIC ACID METHYL ESTER, AJ-21332, AK-90139, SC-47386, SY033634, TS-01995, AB0032017, DB-030009, TC-151813, 4CH-003057, CS-0037030, FT-0646185, X5277, MFCD00023617 (95%), Q-1121, 998P259, A825800, methylpyridine-3-acetate, 2-Bromo-4-iodobenzaldehyde, C8H9NO2, C8-H9-N-O2, CID96475, AR-1J5216, ACN-028382, 421-85-2, 40134-18-7,

Complexity	136
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	151.063g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	151.165g/mol
Monoisotopic Mass	151.063g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	39.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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