AG003NR3

854207-66-2 | (4-Methanesulfonylphenyl)(phenyl)methanamine

AG003NR3

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CAS Number	854207-66-2
Catalog Number	AG003NR3(AGN-PC-04PC46)
Chemical Name	(4-Methanesulfonylphenyl)(phenyl)methanamine
IUPAC Name	(4-methylsulfonylphenyl)-phenylmethanamine
InChI	InChI=1S/C14H15NO2S/c1-18(16,17)13-9-7-12(8-10-13)14(15)11-5-3-2-4-6-11/h2-10,14H,15H2,1H3
InChI Key	HYBYEQCJDVSSKN-UHFFFAOYSA-N
MDL Number	MFCD09806104
Molecular Formula	C14H15NO2S
Molecular Weight	261.3394
SMILES	NC(C1=CC=C(S(=O)(C)=O)C=C1)C2=CC=CC=C2
Synonyms	854207-66-2, alpha-(4-Methylsulfonylphenyl)benzylamine, (4-(Methylsulfonyl)phenyl)(phenyl)methanamine, (4-METHANESULFONYLPHENYL)(PHENYL)METHANAMINE, SCHEMBL5811040, CTK8E1834, KS-000009IN, 6515AJ, KM2321, MFCD09806104, AKOS000169521, AKOS022187152, IMED291315101, TRA0054713, AS-32236, SY019623, alpha -(4-Methylsulfonylphenyl)benzylamine, AX8268684, TC-308062, MFCD09806104 (97+%), C14H15NO2S, [4-(methylsulfonyl)phenyl](phenyl)methylamine, 15184-96-0,

Complexity	347
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	261.082g/mol
Formal Charge	0
Heavy Atom Count	18
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	261.339g/mol
Monoisotopic Mass	261.082g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	68.5A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	1.7

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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