AG003EYJ

154403-85-7 | 3-Pyridineacetonitrile,6-methoxy-(9CI)

AG003EYJ

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CAS Number	154403-85-7
Catalog Number	AG003EYJ(AGN-PC-07AAB1)
Chemical Name	3-Pyridineacetonitrile,6-methoxy-(9CI)
IUPAC Name	2-(6-methoxypyridin-3-yl)acetonitrile
InChI	InChI=1S/C8H8N2O/c1-11-8-3-2-7(4-5-9)6-10-8/h2-3,6H,4H2,1H3
InChI Key	RGHZXZCNIZIVGY-UHFFFAOYSA-N
MDL Number	MFCD09923786
Molecular Formula	C8H8N2O
Molecular Weight	148.1619
SMILES	N#CCC1=CC=C(OC)N=C1
Synonyms	154403-85-7, 2-(6-METHOXYPYRIDIN-3-YL)ACETONITRILE, 2-(6-Methoxy-3-pyridinyl)acetonitrile, (6-methoxy-pyridin-3-yl)-acetonitrile, 3-Pyridineacetonitrile, 6-methoxy-, (6-methoxypyridin-3-yl)acetonitrile, PYR271, SCHEMBL2370767, 2-Methoxypyridine-5-acetonitrile, DTXSID50663801, RGHZXZCNIZIVGY-UHFFFAOYSA-N, KS-00000EK4, 1227AJ, MFCD09923786, ZINC39051329, AKOS006313120, MCULE-8763701198, NE14610, TRA0077739, AJ-97537, AS-41709, SY033386, FT-0732606, J1217, MFCD09923786 (95%), Z1357774223, C8H8N2O, 3-Pyridineacetonitrile, 6-methoxy- (9CI), 172478-10-3,

Complexity	161
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	148.064g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	148.165g/mol
Monoisotopic Mass	148.064g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	45.9A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.8

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P280-P305+P351+P338-P310
UN Code

Certificate of Analysis

Lot Number