AG009WPM

122116-12-5 | 2-(2-Propynyloxy)ethylamine

AG009WPM

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CAS Number	122116-12-5
Catalog Number	AG009WPM(AGN-PC-01UVS0)
Chemical Name	2-(2-Propynyloxy)ethylamine
IUPAC Name	2-prop-2-ynoxyethanamine
InChI	InChI=1S/C5H9NO/c1-2-4-7-5-3-6/h1H,3-6H2
InChI Key	MZFRRBQTCNHISM-UHFFFAOYSA-N
MDL Number	MFCD16713446
Molecular Formula	C5H9NO
Molecular Weight	99.1311
SMILES	NCCOCC#C
Synonyms	2-(2-Propynyloxy)ethylamine, 122116-12-5, 2-(prop-2-ynyloxy)ethanamine, Propargyl-PEG1-amine, (2-Propargyloxyethyl)amine, MZFRRBQTCNHISM-UHFFFAOYSA-N, MFCD16713446, ZINC51864320, AKOS011628075, 2-(prop-2-yn-1-yloxy)ethan-1-amine, BP-22770, P2166,

Complexity	71.4
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	99.068g/mol
Formal Charge	0
Heavy Atom Count	7
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	99.133g/mol
Monoisotopic Mass	99.068g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	35.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-0.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	8(3)
Hazard statements	H226-H314
Packing Group	Ⅱ
Precautionary statements	P210-P233-P240-P241+P242+P243-P260-P264-P280-P301+P330+P331+P310-P303+P361+P353+P310+P363-P304+P340+P310-P305+P351+P338+P310-P370+P378-P403+P235-P405-P501
UN Code	UN 2734

Certificate of Analysis

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