AG0074EX

195140-86-4 | 6-Isopropoxynicotinonitrile

AG0074EX

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CAS Number	195140-86-4
Catalog Number	AG0074EX(AGN-PC-03WZP5)
Chemical Name	6-Isopropoxynicotinonitrile
IUPAC Name	6-propan-2-yloxypyridine-3-carbonitrile
InChI	InChI=1S/C9H10N2O/c1-7(2)12-9-4-3-8(5-10)6-11-9/h3-4,6-7H,1-2H3
InChI Key	JOGPZXCZAZFDHV-UHFFFAOYSA-N
MDL Number	MFCD09930873
Molecular Formula	C9H10N2O
Molecular Weight	162.1885
SMILES	N#CC1=CN=C(OC(C)C)C=C1
Synonyms	6-isopropoxynicotinonitrile, 195140-86-4, 2-isopropoxy-5-cyanopyridine, 3-Pyridinecarbonitrile,6-(1-methylethoxy)-, 6-propan-2-yloxypyridine-3-carbonitrile, 6-ISOPROPOXYPYRIDINE-3-CARBONITRILE, SCHEMBL2814424, CTK4E1701, DTXSID10629120, JOGPZXCZAZFDHV-UHFFFAOYSA-N, KS-00000RP2, MFCD09930873, ZINC19430934, AKOS000171542, DS-5626, QC-6468, AJ-73475, AK136951, EN001542, 6-(propan-2-yloxy)pyridine-3-carbonitrile, ST2406502, 4CH-017013, CS-0035625, FT-0083025, FT-0651274, Z2573, 3-Pyridinecarbonitrile, 6-(1-methylethoxy)-, 6-[(Propan-2-yl)oxy]pyridine-3-carbonitrile, I02-1984, C9H10N2O,

Complexity	182
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	162.079g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	162.192g/mol
Monoisotopic Mass	162.079g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	45.9A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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