AG003O96

7545-50-8 | 3,3'-Diamino-4,4'-dihydroxydiphenyl sulfone

AG003O96

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CAS Number	7545-50-8
Catalog Number	AG003O96(AGN-PC-0JLTNH)
Chemical Name	3,3'-Diamino-4,4'-dihydroxydiphenyl sulfone
EC Number	231-428-8
IUPAC Name	2-amino-4-(3-amino-4-hydroxyphenyl)sulfonylphenol
InChI	InChI=1S/C12H12N2O4S/c13-9-5-7(1-3-11(9)15)19(17,18)8-2-4-12(16)10(14)6-8/h1-6,15-16H,13-14H2
InChI Key	KECOIASOKMSRFT-UHFFFAOYSA-N
MDL Number	MFCD00025181
Molecular Formula	C12H12N2O4S
Molecular Weight	280.2997
NSC Number	155173
SMILES	O=S(C1=CC=C(O)C(N)=C1)(C2=CC=C(O)C(N)=C2)=O
Synonyms	7545-50-8, 3,3'-Diamino-4,4'-dihydroxydiphenyl Sulfone, 4,4'-Sulfonylbis(2-aminophenol), Bis(3-amino-4-hydroxyphenyl) Sulfone, Bis(3-amino-4-hydroxyphenyl)sulfone, 2-amino-4-[(3-amino-4-hydroxyphenyl)sulfonyl]phenol, 4,4'-Sulphonylbis(2-aminophenol), 4,4'-sulphonylbis[2-aminophenol], NSC155173, 3-amino-4-hydroxyphenyl sulfone, Phenol, 4,4'-sulfonylbis[2-amino-, AK-50096, 3,3-Diamino-4,4-Dihydroxydiphenyl Sulfone, 2-amino-4-(3-amino-4-hydroxybenzenesulfonyl)phenol, 2-amino-4-(3-amino-4-hydroxyphenyl)sulfonylphenol, EINECS 231-428-8, ACMC-209oyf, AC1Q6UHW, AC1L32MX, AC1Q51HK, AC1Q51HL, Cambridge id 5105145, Oprea1_144507, Oprea1_606502, CBDivE_002025, MLS000673851, SCHEMBL109925, ARONIS016718, CHEMBL1566370, CTK5E1581, KS-00000NCG, ZINC36432, DTXSID40226383, KECOIASOKMSRFT-UHFFFAOYSA-N, HMS2774C03, 3-Amino-?4-?hydroxyphenyl Sulfone, ACT07462, ALBB-006612, ZX-AN006271, Phenol,4,4'-sulfonylbis[2-amino-, ANW-36613, MFCD00025181, STK025810, 2,2'-Diamino-4,4'-sulfonyldiphenol, AKOS000266219, MCULE-1716090328, NSC-155173, RTR-024267, VZ26238, KS-000049B8, NCGC00245961-01, AJ-08711, DS-15330, SC-24886, SMR000315092, ST052014, ZB001003, AB0066244, AX8081291, BB0272992, TR-024267, B2859, EU-0099868, FT-0081676, R1542, ST24041086, Z5558, 545D508, C-17635, I06-1455, 2-amino-4-(3-amino-4-hydroxy-phenyl)sulfonyl-phenol, 2-amino-4-[(3-amino-4-hydroxybenzene)sulfonyl]phenol, A0608/0028142, 2-AMINO-4-[(3-AMINO-4-HYDROXYPHENYL)-SULFONYL]PHENOL, C12H12N2O4S, CID82047, AR-1F8166, C12-H12-N2-O4-S, Phenol, 4,4'-sulfonylbis(2-amino-, ACN-052737, Bis(3-amino-4-hydroxyphenyl) sulfone, 98% - 25G 25g, 79309-63-0,

Complexity	376
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	280.052g/mol
Formal Charge	0
Heavy Atom Count	19
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	4
Isotope Atom Count	0
Molecular Weight	280.298g/mol
Monoisotopic Mass	280.052g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	135A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.6

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H317-H319
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

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