AG003QBN

54401-85-3 | Ethyl 2-(pyridin-4-yl)acetate

AG003QBN

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CAS Number	54401-85-3
Catalog Number	AG003QBN(AGN-PC-0JVOAZ)
Chemical Name	Ethyl 2-(pyridin-4-yl)acetate
EC Number	259-150-2
IUPAC Name	ethyl 2-pyridin-4-ylacetate
InChI	InChI=1S/C9H11NO2/c1-2-12-9(11)7-8-3-5-10-6-4-8/h3-6H,2,7H2,1H3
InChI Key	QVLJLWHOILVHJJ-UHFFFAOYSA-N
MDL Number	MFCD00051830
Molecular Formula	C9H11NO2
Molecular Weight	165.1891
SMILES	O=C(OCC)CC1=CC=NC=C1
Synonyms	54401-85-3, Ethyl 4-pyridylacetate, Ethyl 2-(pyridin-4-yl)acetate, Ethyl pyridine-4-acetate, 4-Pyridineacetic Acid Ethyl Ester, ethyl pyridin-4-ylacetate, 4-Pyridineacetic acid, ethyl ester, ethyl 2-(4-pyridyl)acetate, Ethyl 4-pyridylacetate, 97%, 4-Pyridylacetic Acid Ethyl Ester, QVLJLWHOILVHJJ-UHFFFAOYSA-N, MFCD00051830, J-640117, J-650128, Ethyl 4-Pyridineacetate, EINECS 259-150-2, ethyl-4-pyridylacetate, PubChem12839, ethyl 4-pyridinylacetate, AC1LEHV0, ethyl pyridine-4-ylacetate, ACMC-209lg4, AC1Q34PG, ETHYL4-PYRIDYLACETATE, ethyl 2-pyridin-4-ylacetate, SCHEMBL304656, ethyl 2-(4-pyridinyl)acetate, ethyl 2-pyridin-4-ylethanoate, AC1Q653F, DTXSID30202797, ZINC157105, KS-000012TR, 7856AB, ANW-32066, SBB053836, 2-pyridin-4-ylacetic acid ethyl ester, AKOS005206776, CS-W017889, FG-0450, MCULE-1656628085, AJ-14885, AK-80326, BBV-37717259, CJ-01589, SC-73882, TZ000773, 2-(pyridin-4-yl)ethanoic acid ethyl ester, AX8034033, TC-120811, TR-019235, FT-0619455, P1399, ST50406939, L-2095, A830159, I02-3047, J-800117, InChI=1/C9H11NO2/c1-2-12-9(11)7-8-3-5-10-6-4-8/h3-6H,2,7H2,1H, Ethyl2-(pyridin-4-yl)acetate, C9H11NO2, C9-H11-N-O2, 2-(piperidin-4-yl)-acetic acid ethyl ester, AR-1J0031, CID736321, ZINC00157105, ACN-041795, 2,4-diamino-5-phenylthiazol hydrobromide, 59184-90-6, 5450-66-8,

Complexity	142
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	165.079g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	165.192g/mol
Monoisotopic Mass	165.079g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	39.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.7

GHS Hazard and Precautionary Statements

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

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