AG007KC5

29768-03-4 | 3-(Pyridin-2-yl)prop-2-yn-1-ol

AG007KC5

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CAS Number	29768-03-4
Catalog Number	AG007KC5(AGN-PC-0KV4SZ)
Chemical Name	3-(Pyridin-2-yl)prop-2-yn-1-ol
IUPAC Name	3-pyridin-2-ylprop-2-yn-1-ol
InChI	InChI=1S/C8H7NO/c10-7-3-5-8-4-1-2-6-9-8/h1-2,4,6,10H,7H2
InChI Key	JBTFIWAQYSBSEZ-UHFFFAOYSA-N
MDL Number	MFCD00168870
Molecular Formula	C8H7NO
Molecular Weight	133.1473
SMILES	OCC#CC1=NC=CC=C1
Synonyms	3-(Pyridin-2-yl)prop-2-yn-1-ol, 29768-03-4, 3-(2-Pyridyl)-2-propyn-1-ol, 2-Propyn-1-ol, 3-(2-pyridinyl)-, 3-(pyridin-2-yl)prop-2-yn-1-yl alcohol, 3-pyridin-2-ylprop-2-yn-1-ol, pyridylethynylcarbinol, AC1MQR4I, SCHEMBL3346509, CTK0J1103, DTXSID30392884, JBTFIWAQYSBSEZ-UHFFFAOYSA-N, 3-(2-Pyridyl)-2-propin-1-ol, 3-(2-Pyridyl)-2-propyne-1-ol, 5627AJ, MFCD00168870, ZINC13227925, AKOS005216111, 3-(2-pyridyl)prop-2-yn-1-yl alcohol, AJ-63507, SY022166, MFCD00168870 (95%), F8885-6318, Z2218556534, C8H7NO, CID3481147,

Complexity	153
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	133.053g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	133.15g/mol
Monoisotopic Mass	133.053g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	33.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.4

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

Lot Number