AG003ITT

662116-71-4 | 3-Amino-1-methanesulfonylpyrrolidine

AG003ITT

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CAS Number	662116-71-4
Catalog Number	AG003ITT(AGN-PC-09SGCN)
Chemical Name	3-Amino-1-methanesulfonylpyrrolidine
IUPAC Name	1-methylsulfonylpyrrolidin-3-amine
InChI	InChI=1S/C5H12N2O2S/c1-10(8,9)7-3-2-5(6)4-7/h5H,2-4,6H2,1H3
InChI Key	UDYSDVVJHGYAHB-UHFFFAOYSA-N
MDL Number	MFCD12198865
Molecular Formula	C5H12N2O2S
Molecular Weight	164.2260
SMILES	NC1CN(S(=O)(C)=O)CC1
Synonyms	3-AMINO-1-METHANESULFONYLPYRROLIDINE, 662116-71-4, 1-(METHYLSULFONYL)PYRROLIDIN-3-AMINE, 3-Pyrrolidinamine, 1-(methylsulfonyl)-, (S)-1-(Methylsulfonyl)pyrrolidin-3-amine, 1-(Methanesulfonyl)pyrrolidin-3-amine, 1-(METHYLSULFONYL)-3-PYRROLIDINAMINE, ACMC-209nu1, SCHEMBL67599, CTK7D9961, DTXSID70693847, UDYSDVVJHGYAHB-UHFFFAOYSA-N, ANW-35159, KM0997, MFCD12198865, 1-methanesulfonyl-pyrrolidin-3-ylamine, AKOS011347590, PB17961, TRA0053780, 3-?Amino-?1-?methanesulfonylpyrro?lidine, AS-31598, SY005629, AB1000533, DB-073720, TC-123904, CS-0040464, FT-0722016, V7172, MFCD12198865 (95+%), I11-0589, null, C5H12N2O2S, 773053-81-9,

Complexity	206
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	164.062g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	164.223g/mol
Monoisotopic Mass	164.062g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	71.8A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	-1.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	6.1
Hazard statements	H302-H315-H319-H335
Packing Group	Ⅲ
Precautionary statements	P261-P305+P351+P338
UN Code	UN 2811

Certificate of Analysis

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