AG003DXG

76697-50-2 | 1-Amino-2-(isopropylsulphonyl)benzene

AG003DXG

SDS

COA

Price

$0.00

Add to Cart

Buy Now

WARNING This product is not for human or veterinary use.

CAS Number	76697-50-2
Catalog Number	AG003DXG(AGN-PC-0NJQSV)
Chemical Name	1-Amino-2-(isopropylsulphonyl)benzene
IUPAC Name	2-propan-2-ylsulfonylaniline
InChI	InChI=1S/C9H13NO2S/c1-7(2)13(11,12)9-6-4-3-5-8(9)10/h3-7H,10H2,1-2H3
InChI Key	GMLAMRMKROYXNZ-UHFFFAOYSA-N
MDL Number	MFCD08445603
Molecular Formula	C9H13NO2S
Molecular Weight	199.2700
SMILES	O=S(C1=CC=CC=C1N)(C(C)C)=O
Synonyms	1-Amino-2-(isopropylsulphonyl)benzene, 76697-50-2, 2-(ISOPROPYLSULFONYL)ANILINE, 2-(propane-2-sulfonyl)aniline, 2-(Isopropylsulphonyl)aniline, 2-Aminophenyl isopropyl sulfone, 2-(propan-2-ylsulfonyl)aniline, GMLAMRMKROYXNZ-UHFFFAOYSA-N, MFCD08445603, Benzenamine, 2-[(1-methylethyl)sulfonyl]-, 1-Amino-2-(isopropylsulfonyl)benzene, 2-isopropylsulfonylaniline, AC1Q1QT3, 2-propan-2-ylsulfonylaniline, KSC643G2H, 2-(isopropylsulfonyl) aniline, SCHEMBL1015219, 2-(isopropylsulfonyl)benzenamine, CTK5E3323, 2-(iso-propylsulfonyl)benzenamine, DTXSID70505557, 2-(propane-2-sulfonyl)phenylamine, ACT10259, BCP12286, CS-M2891, AN-064, ANW-49315, ZINC16123532, AKOS010625403, AS04676, CA-1954, CM11110, GS-4017, MCULE-2097714298, RP25712, SB17678, TRA0022228, KS-000009Y4, [2-[(Propan-2-yl)sulfonyl]phenyl]amine, AC-29713, AJ-68223, AK-36330, BR-36330, CJ-15301, SC-82754, SY028185, Benzenamine,2-[(1-methylethyl)sulfonyl]-, AB0007430, DB-005665, ST2415133, TC-030698, 4CH-003009, AM20080582, FT-0600371, I1033, W8346, EN300-65799, S-3651, MFCD08445603 (95+%), 697A502, A838802, I09-1597, J-504178, Z1262398422, C9H13NO2S, 1-AMINO-2- BENZENE, ACN-050750, C2873,

Complexity	253
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	199.067g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	199.268g/mol
Monoisotopic Mass	199.067g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	68.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.7

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