AG0025BW

17747-43-2 | 3-Pyridinol, 3-acetate

AG0025BW

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CAS Number	17747-43-2
Catalog Number	AG0025BW(AGN-PC-0JLWP1)
Chemical Name	3-Pyridinol, 3-acetate
EC Number	241-742-7
IUPAC Name	pyridin-3-yl acetate
InChI	InChI=1S/C7H7NO2/c1-6(9)10-7-3-2-4-8-5-7/h2-5H,1H3
InChI Key	QZDWODWEESGPLC-UHFFFAOYSA-N
MDL Number	MFCD00006377
Molecular Formula	C7H7NO2
Molecular Weight	137.1360
NSC Number	273047
SMILES	CC(OC1=CC=CN=C1)=O
UNII	9E55385Q47
Synonyms	3-Acetoxypyridine, pyridin-3-yl acetate, 17747-43-2, 3-Pyridyl acetate, 3-acetoxy pyridine, 3-Pyridinol, acetate (ester), UNII-9E55385Q47, 3-Hydroxypyridine monoacetate, QZDWODWEESGPLC-UHFFFAOYSA-N, 9E55385Q47, EINECS 241-742-7, 3-Pyridinol, acetate, 3-Pyridinyl acetate #, AI3-52430, 3-Acetoxypyridine, 99%, ACMC-1C8RR, AC1L3DC3, SCHEMBL909511, AC1Q61T9, CTK8B1024, DTXSID20170315, ZINC388199, ALBB-021947, KS-000016AG, 9315AA, ANW-22878, MFCD00006377, NSC273047, AKOS015892100, MCULE-6451249272, NSC-273047, RP20347, VP14449, AJ-20484, ZB011353, AB0117019, DB-044300, TC-111623, A1210, FT-0614871, R1142, ST24049068, I02-2925, J-511496, InChI=1/C7H7NO2/c1-6(9)10-7-3-2-4-8-5-7/h2-5H,1H, Pyridin-3-ylacetate, C7H7NO2, C7-H7-N-O2, CID87289, AR-1L2657, 18138-03-9,

Complexity	125
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	137.048g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	137.138g/mol
Monoisotopic Mass	137.048g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	39.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.8

GHS Hazard and Precautionary Statements

Symbol:
Hazard statements	H315-H319-H335
Precuationary statements	P261-P305+P351+P338
Siginal words

Certificate of Analysis

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