AG003I01

1050556-38-1 | 3-(2-Amino-4-thiazolyl)phenol, HCl

AG003I01

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CAS Number	1050556-38-1
Catalog Number	AG003I01(AGN-PC-01C0PF)
Chemical Name	3-(2-Amino-4-thiazolyl)phenol, HCl
IUPAC Name	3-(2-amino-1,3-thiazol-4-yl)phenol;hydrochloride
InChI	InChI=1S/C9H8N2OS.ClH/c10-9-11-8(5-13-9)6-2-1-3-7(12)4-6;/h1-5,12H,(H2,10,11);1H
InChI Key	NJQDMVOVOWVSPZ-UHFFFAOYSA-N
MDL Number	MFCD08582775
Molecular Formula	C9H9ClN2OS
Molecular Weight	228.6986
SMILES	OC1=CC=CC(C2=CSC(N)=N2)=C1.[H]Cl
Synonyms	1050556-38-1, 3-(2-amino-4-thiazolyl)Phenol hydrochloride, 3-(2-Aminothiazol-4-yl)phenol hydrochloride, 3-(2-AMINO-THIAZOL-4-YL)-PHENOL HYDROCHLORIDE, 3-(2-AMINO-4-THIAZOLYL)PHENOL HCL, CTK8A0063, KS-00000A4W, 8136AC, MFCD08582775, 3-(2-Amino-4-thiazolyl)phenol, HCl, AKOS015847594, MCULE-3051918013, TRA0025153, AS-31718, SY012616, 3-(2-Amino-4-thiazolyl)phenolHydrochloride, AB0032978, AX8269001, DB-059295, TR-050013, FT-0757206, X6425, Z-4204, MFCD08582775 (95+%), C9H9ClN2OS, C9H8N2OS, 3-(2-Amino-1,3-thiazol-4-yl)phenol hydrochloride, 155983-86-1, 104-58-5,

Complexity	179
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	228.012g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	3
Isotope Atom Count	0
Molecular Weight	228.694g/mol
Monoisotopic Mass	228.012g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	87.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

Lot Number