AG003CIU

54656-96-1 | (S)-1-(Pyridin-4-yl)ethanol

AG003CIU

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CAS Number	54656-96-1
Catalog Number	AG003CIU(AGN-PC-0SHR2C)
Chemical Name	(S)-1-(Pyridin-4-yl)ethanol
IUPAC Name	(1S)-1-pyridin-4-ylethanol
InChI	InChI=1S/C7H9NO/c1-6(9)7-2-4-8-5-3-7/h2-6,9H,1H3/t6-/m0/s1
InChI Key	HVOAMIOKNARIMR-LURJTMIESA-N
MDL Number	MFCD00077866
Molecular Formula	C7H9NO
Molecular Weight	123.1525
SMILES	C[C@H](O)C1=CC=NC=C1
Synonyms	(S)-1-(Pyridin-4-yl)ethanol, 54656-96-1, (S)-(-)-1-(4-Pyridyl)ethanol, (1S)-1-(pyridin-4-yl)ethan-1-ol, (S)-4-(1-Hydroxyethyl)pyridine, 99+%, (99+% ee), (S)-4-(1-Hydroxyethyl)pyridine, AC1Q29NQ, (S)-1-(4-Pyridyl)ethanol, (1S)-1-(4-pyridyl)ethanol, (S)-1-(4-Pyridinyl)ethanol, SCHEMBL3062521, (1s)-1-(4-pyridinyl)ethanol, CTK5A2115, KS-00000LMJ, HVOAMIOKNARIMR-LURJTMIESA-N, ZINC391917, (-)-(S)-1-(4-pyridyl)ethanol, 7927AB, ANW-58619, CP-529, MFCD00077866, (S)-(-)-1-(4-pyridyl)-ethanol, AKOS010377529, NE32196, WT82091, 4-Pyridinemethanol, a-methyl-, (aS)-, (S)-(-)-|A-Methyl-4-pyridinemethanol, AJ-21170, AN-40545, TS-01631, ZB012121, (S)-(-)-alpha-Methyl-4-pyridinemethanol, TC-147364, FT-0656333, EN300-53670, (S)-(-)-alpha-Methyl-4-pyridinemethanol, 99%, 656P961, 4-Pyridinemethanol, .alpha.-methyl-, (.alpha.S)-, I02-1114, (S)-(-)-alpha-Methyl-4-pyridinemethanol, puriss., >=99.0% (sum of enantiomers, GC), C7H9NO, 1-PYRIDIN-4-YL-ETHANOL, (S)-4-(1-Hydroxyethyl) pyridine, EINECS 245-630-9, CID10920507, (S)-(-)-1-(4-Pyridyl)ethanol, 95% - 1G 1g, 23389-75-5,

Complexity	79
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	123.068g/mol
Formal Charge	0
Heavy Atom Count	9
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	123.155g/mol
Monoisotopic Mass	123.068g/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
Signal Words	warning
UN Code

Certificate of Analysis

Lot Number