AG0038N6

5693-62-9 | 6-Methoxy-2,3,4,5-tetrahydropyridine

AG0038N6

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CAS Number	5693-62-9
Catalog Number	AG0038N6(AGN-PC-0JMQ7F)
Chemical Name	6-Methoxy-2,3,4,5-tetrahydropyridine
IUPAC Name	6-methoxy-2,3,4,5-tetrahydropyridine
InChI	InChI=1S/C6H11NO/c1-8-6-4-2-3-5-7-6/h2-5H2,1H3
InChI Key	YNTUHDRALXNDEQ-UHFFFAOYSA-N
MDL Number	MFCD00792425
Molecular Formula	C6H11NO
Molecular Weight	113.1576
SMILES	COC=1CCCCN1
Synonyms	o-Methylvalerolactim, 6-methoxy-2,3,4,5-tetrahydropyridine, 5693-62-9, 2-methoxy-3,4,5,6-tetrahydropyridine, 2-Methylvalericacidanhydride, O-Methylpentanolactim, O-methyl valerolactim, 2,3,4,5-tetrahydro-6-methoxypyridine, AC1L3D3J, AC1Q4FC6, SCHEMBL343554, CTK5A5984, DTXSID00205477, YNTUHDRALXNDEQ-UHFFFAOYSA-N, ZINC4269306, 8337AB, MFCD00792425, STL299810, AKOS005146179, FS-4331, MCULE-3080988027, 3,4,5,6-Tetrahydro-2-methoxypyridine, 2-methoxy-3,4,5,6-tetrahydro-pyridine, 6-methoxy-2,3,4,5-tetrahydro pyridine, 6-methoxy-2,3,4,5-tetrahydro-pyridine, AJ-49973, SC-21460, DB-000599, Pyridine, 2,3,4,5-tetrahydro-6-methoxy-, FT-0635809, EN300-51819, A831244, I14-11245, Z1245634052, C6H11NO, 1-aza-2-methoxy-1-cyclohexene, CID138567, ZINC04269306, A8133,

Complexity	98.7
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	113.084g/mol
Formal Charge	0
Heavy Atom Count	8
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	113.16g/mol
Monoisotopic Mass	113.084g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	21.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.4

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	3
Hazard statements	H226-H315-H319-H335
Packing Group	Ⅲ
Precautionary statements	P261-P305+P351+P338
Signal Words	danger
UN Code	UN 1993

Certificate of Analysis

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