AG00IBEF

6471-78-9 | Benzenesulfonic acid, 4-amino-5-methoxy-2-methyl-

AG00IBEF

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CAS Number	6471-78-9
Catalog Number	AG00IBEF(AGN-PC-0JLSXX)
Chemical Name	Benzenesulfonic acid, 4-amino-5-methoxy-2-methyl-
EC Number	229-319-5
IUPAC Name	4-amino-5-methoxy-2-methylbenzenesulfonic acid
InChI	InChI=1S/C8H11NO4S/c1-5-3-6(9)7(13-2)4-8(5)14(10,11)12/h3-4H,9H2,1-2H3,(H,10,11,12)
InChI Key	JBAVAJIXZVRJHT-UHFFFAOYSA-N
MDL Number	MFCD00035949
Molecular Formula	C8H11NO4S
Molecular Weight	217.2422
SMILES	O=S(C1=CC(OC)=C(N)C=C1C)(O)=O
UNII	308K033X64
Synonyms	6471-78-9, 4-Amino-5-methoxy-2-methylbenzenesulfonic acid, Benzenesulfonic acid, 4-amino-5-methoxy-2-methyl-, 4-Amino-5-methoxy-2-methylbenzensulfonic acid, 3-Amino-4-methoxy-toluene-6-sulfonic acid, p-Cresidine-4-sulfonic acid, UNII-308K033X64, 5-Methoxy-2-methylsulphanilic acid, EINECS 229-319-5, o-Toluenesulfonic acid, 4-amino-5-methoxy-, 308K033X64, W-104821, 4-Amino-5-methoxy-2-toluenesulfonic acid, 3-Amino-4-methoxytoluene-6-sulfonic acid, Cresidine-p-sulfonic Acid, p-Cresidine suruhonic acid, AC1L30CA, p-Cresidine-O-sulfonic acid, SCHEMBL153566, DTXSID2027628, CTK6J5304, JBAVAJIXZVRJHT-UHFFFAOYSA-N, 2-Methoxy-5-methyl-4-sulfoaniline, ZINC2243589, MFCD00035949, AKOS007930301, FCH1329395, 4-Amino-5-methoxy-o-toluenesulfonic Acid, AC-10720, AJ-34357, AK122467, AN-20058, AS-15537, CC-17845, P783, SC-18346, 2-methoxy-5-methylaniline-4-sulfonic acid, 4-amino-5-methoxytoluene-2-sulphonic acid, AX8022011, DB-073529, LS-169272, FT-0618279, ST24043232, 4-amino-5-methoxy-2-methyl-benzenesulfonic acid, 4-Amino-5-methoxy-2-methylbenzenesulfonic acid #, 4-azanyl-5-methoxy-2-methyl-benzenesulfonic acid, 471A789, A834865, C-35095, I05-0158, C8H11NO4S, C8-H11-N-O4-S, CID80961, 4-Amino-5-methoxy-2-methylbenzensulfonicacid, 4-Amino-5-methoxy-2-methylbenzenesulfonicacid,

Complexity	284
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	217.041g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	217.239g/mol
Monoisotopic Mass	217.041g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	98A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.3

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

Lot Number