AG000CPZ

116539-55-0 | 2-Thiophenemethanol, α-[2-(methylamino)ethyl]-, (αS)-

AG000CPZ

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CAS Number	116539-55-0
Catalog Number	AG000CPZ(AGN-PC-0P965C)
Chemical Name	2-Thiophenemethanol, α-[2-(methylamino)ethyl]-, (αS)-
EC Number	601-437-5
IUPAC Name	(1S)-3-(methylamino)-1-thiophen-2-ylpropan-1-ol
InChI	InChI=1S/C8H13NOS/c1-9-5-4-7(10)8-3-2-6-11-8/h2-3,6-7,9-10H,4-5H2,1H3/t7-/m0/s1
InChI Key	YEJVVFOJMOHFRL-ZETCQYMHSA-N
MDL Number	MFCD07357308
Molecular Formula	C8H13NOS
Molecular Weight	171.2599
SMILES	CNCC[C@H](O)C1=CC=CS1
UNII	43P2XE546O
Synonyms	116539-55-0, (S)-(-)-3-(N-methylamino)-1-(2-thienyl)-1-propanol, (S)-3-(Methylamino)-1-(thiophen-2-yl)propan-1-ol, (1S)-3-(methylamino)-1-(thiophen-2-yl)propan-1-ol, UNII-43P2XE546O, Duloxetine EP IMpurity B, (S)-3-(Methylamino)-1-(2-thienyl)-1-propanol, 3-(N-Methylamino)-1-(2-thienyl)-1-propanol, (-)-, 43P2XE546O, (S)-3-(Methylamino)-1-(2-thienyl)propan-1-ol, (S)-(-)-3-methylamino-1-(2-thienyl)propan-1-ol, (S)-3-METHYLAMINO-1-THIOPHEN-2-YL-PROPAN-1-OL, (1S)-3-methylamino-1-(2-thienyl)-1-propanol, (1S)-3-(methylamino)-1-(2-thienyl)propan-1-ol, 2-Thiophenemethanol, alpha-(2-(methylamino)ethyl)-, (alphaS)-, 2-Thiophenemethanol, alpha-[2-(methylamino)ethyl]-, (alphaS)-, AK-46639, Duloxetine hydrochloride impurity B [EP], EC 601-437-5, SCHEMBL98019, N-Methyl-(S)-(-)-3-hydroxy-3-(2-thiophen)propylamine, CTK4A9846, (1S)-(-)-3-(Methylamino)-1-(thien-2-yl)propan-1-ol, DTXSID20151422, YEJVVFOJMOHFRL-ZETCQYMHSA-N, ACN-S003511, ACT07226, CS-M3028, ANW-52363, CM-452, FCH854901, MFCD07357308, ZINC14982906, AKOS006284313, AC-5321, DS-1147, AJ-65752, AN-11084, BC216616, BR-46639, OR350354, SC-24208, AB0004798, AX8048082, DB-001143, ST2408233, TX-010077, FT-0658141, M2157, S-1995, (1S)-3-(methylamino)-1-(2-thienyl)-1-propanol, (S) -3-Methyl-amino-1-(2-thienyl)-1-propanol, (s)-n-methyl-3-hydroxy-3-(2-thienyl)propylamine, (1S)-3-(methylamino)-1-thiophen-2-ylpropan-1-ol, (S)-2-[3-(Methylamino)-1-hydroxypropyl]thiophene, (S)-3-(n-methylamino)-1-(2-thienyl)-1-propanol, (S)-(-)-3-methylamino-1-(2-thienyl)-propan-1-ol, (S)-(-)-3-Methylamino-1-thiophen-2-yl-propan-1-ol, (S)-3-METHYLAMINO-1-(2-THIENYL)-1-PROPANOL, (S)-N-methyl-3-hydroxy-3-(2-thienyl)-1-propanamine, (S)-(-)-N -Methyl-3-hydroxy-3-(2-thienyl)propanami, 2-Thiophenemethanol, a-[2-(methylamino)ethyl]-, (aS)-, S)-(-)-N -Methyl-3-hydroxy-3-(2-thienyl)propanamine, UNII-MN1J3TV06Q component YEJVVFOJMOHFRL-ZETCQYMHSA-N, Rivaroxaban, 2-(Trimethylsiloxy)furan, C8H13NOS, 3-Methylamino-1-(2-thienyl)-1-propanol, CID10095047, (1S)-3-methylamino-1-thiophen-2-yl-propan-1-ol, (S)-3-Methylamino-1-(thiophene-2-yl)propan-1-ol, 3-Methylamino-1-thiophen-2-yl-propan-1-ol 1HCl salt, 116539-56-1, 214701-49-2, 366789-02-8,

Complexity	110
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	171.072g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	171.258g/mol
Monoisotopic Mass	171.072g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	60.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number