AG00ID1W

795299-77-3 | 1-Azetidineethanamine

AG00ID1W

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CAS Number	795299-77-3
Catalog Number	AG00ID1W(AGN-PC-00Q13E)
Chemical Name	1-Azetidineethanamine
IUPAC Name	2-(azetidin-1-yl)ethanamine
InChI	InChI=1S/C5H12N2/c6-2-5-7-3-1-4-7/h1-6H2
InChI Key	RIHYLJLIMZMKTQ-UHFFFAOYSA-N
MDL Number	MFCD19205720
Molecular Formula	C5H12N2
Molecular Weight	100.1622
SMILES	N1(CCC1)CCN
Synonyms	2-(azetidin-1-yl)ethan-1-amine, 795299-77-3, 2-(azetidin-1-yl)ethanamine, 1-Azetidineethanamine, 1-(2-Aminoethyl)azetidine, N-aminoethyl azetidine, N-(2-aminoethyl)azetidine, 2-(Azetidine-1-yl)ethanamine, SCHEMBL1612176, RIHYLJLIMZMKTQ-UHFFFAOYSA-N, MFCD19205720, ZINC34615861, AKOS006338332, NE49541, KS-000005L2, BS-12775, SC-51425, Z1947445969,

Complexity	50
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	100.1g/mol
Formal Charge	0
Heavy Atom Count	7
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	100.165g/mol
Monoisotopic Mass	100.1g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	29.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-0.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	3
Hazard statements	H226-H302-H318
Packing Group	Ⅲ
Precautionary statements	P210-P233-P241-P242-P243-P261-P280-P303+P361+P353-P305+P351+P338
UN Code	UN 1993

Certificate of Analysis

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