AG001D2W

14548-46-0 | Methanone, phenyl-4-pyridinyl-

AG001D2W

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CAS Number	14548-46-0
Catalog Number	AG001D2W(AGN-PC-0JKJ03)
Chemical Name	Methanone, phenyl-4-pyridinyl-
EC Number	238-586-7
IUPAC Name	phenyl(pyridin-4-yl)methanone
InChI	InChI=1S/C12H9NO/c14-12(10-4-2-1-3-5-10)11-6-8-13-9-7-11/h1-9H
InChI Key	SKFLCXNDKRUHTA-UHFFFAOYSA-N
MDL Number	MFCD00006430
Molecular Formula	C12H9NO
Molecular Weight	183.2060
NSC Number	9488
SMILES	O=C(C1=CC=CC=C1)C1=CC=NC=C1
UNII	524YQ3O21T
Synonyms	4-benzoylpyridine, phenyl(4-pyridinyl)methanone, 4-Benzoylpyridine, 14548-46-0, phenyl(pyridin-4-yl)methanone, Phenyl 4-pyridyl ketone, Methanone, phenyl-4-pyridinyl-, Phenyl(4-pyridinyl)methanone, 4-Pyridyl phenyl ketone, Pyridine, 4-benzoyl-, Ketone, phenyl 4-pyridyl, gamma-Benzoylpyridine, Ba 33215, NSC 9488, 4-benzoyl pyridine, UNII-524YQ3O21T, .gamma.-Benzoylpyridine, EINECS 238-586-7, BRN 0003864, SKFLCXNDKRUHTA-UHFFFAOYSA-N, 524YQ3O21T, 4-Benzoylpyridine, 98%, AC1L1BRW, AC1Q5CWK, phenyl 4-pyridinyl ketone, ChemDiv2_000073, WLN: T6NJ DVR, ACMC-209cv7, 5-21-08-00576 (Beilstein Handbook Reference), MLS000084817, SCHEMBL229650, Jsp002662, CHEMBL1446524, DTXSID6022262, [(Pyridin-4-yl)carbonyl]benzene, NSC9488, HMS1369D07, HMS2372M15, ZINC247037, KS-000014AK, NSC-9488, ANW-20945, BBL010518, MFCD00006430, SBB032964, STK014114, AKOS000119486, CCG-103883, MCULE-2317202899, NE10445, RTC-040280, AJ-18336, L647, LS-87349, SC-47100, SMR000019163, ZB009800, DB-042783, TC-040280, TL8001007, B0306, FT-0617638, FT-0617639, ST50406222, A808373, AC-907/25014301, SR-01000399379, I01-1473, SR-01000399379-1, W-108139, Z57069936, InChI=1/C12H9NO/c14-12(10-4-2-1-3-5-10)11-6-8-13-9-7-11/h1-9, C12H9NO, C12-H9-N-O, CID26731, C066738,

Complexity	191
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	183.068g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	183.21g/mol
Monoisotopic Mass	183.068g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	30A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319
Packing Group
Precautionary statements	P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313
UN Code

Certificate of Analysis

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