AG0030OX

30616-38-7 | Phenol, 4-amino-2-(2-benzothiazolyl)-

AG0030OX

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CAS Number	30616-38-7
Catalog Number	AG0030OX(AGN-PC-0O8RGG)
Chemical Name	Phenol, 4-amino-2-(2-benzothiazolyl)-
IUPAC Name	4-amino-2-(1,3-benzothiazol-2-yl)phenol
InChI	InChI=1S/C13H10N2OS/c14-8-5-6-11(16)9(7-8)13-15-10-3-1-2-4-12(10)17-13/h1-7,16H,14H2
InChI Key	UBRCBHVOYDSGKZ-UHFFFAOYSA-N
MDL Number	MFCD00197455
Molecular Formula	C13H10N2OS
Molecular Weight	242.2963
SMILES	OC1=CC=C(N)C=C1C2=NC3=CC=CC=C3S2
Synonyms	4-Amino-2-benzothiazol-2-yl-phenol, 30616-38-7, 4-amino-2-(1,3-benzothiazol-2-yl)phenol, 4-amino-2-(benzo[d]thiazol-2-yl)phenol, Phenol,4-amino-2-(2-benzothiazolyl)-, 2-(2'-hydroxy-5'-aminophenyl) benzothiazole, 4-amino-2-benzothiazol-2-ylphenol, AC1NUCPD, AC1O9YED, AC1O1JK9, AC1Q51LC, Cambridge id 5250059, CBDivE_013053, MLS000104953, SCHEMBL2248026, CHEMBL1422046, CTK4G5487, DTXSID20425211, UBRCBHVOYDSGKZ-UHFFFAOYSA-N, HMS2331C12, 4-Amino-2-(2-benzothiazolyl)phenol, 9662AD, BBL008063, MFCD00197455, SBB007319, STK040463, STL051438, ZINC13121814, AKOS000108902, AKOS005704794, CCG-108974, MCULE-2414464010, Phenol, 4-amino-2-(2-benzothiazolyl)-, BAS 02723711, SMR000054883, AB0167349, TR-042366, 2-(2'-hydroxy-5'-aminophenyl)benzothiazole, BB 0245414, ST50014076, EN300-02280, L-4759, SR-01000461598, 4-amino-2-(1,3-benzothiazol-3-ium-2-yl)phenolate, SR-01000461598-1, F0920-1080, 2-(5-Amino-2-hydroxyphenyl)benzothiazole >=97% (HPLC), 2-(5-Amino-2-hydroxyphenyl)benzothiazole, >=97% (HPLC), (6E)-4-amino-6-(3H-1,3-benzothiazol-2-ylidene)cyclohexa-2,4-dien-1-one, (6Z)-4-amino-6-(3H-1,3-benzothiazol-2-ylidene)cyclohexa-2,4-dien-1-one, 4-amino-6-(3H-1,3-benzothiazol-2-ylidene)cyclohexa-2,4-dien-1-one, C13H10N2OS, ZINC00172523, CID5399223, CID6098117, CID6740806,

Complexity	276
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	242.051g/mol
Formal Charge	0
Heavy Atom Count	17
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	242.296g/mol
Monoisotopic Mass	242.051g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	87.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard statements	H302-H315-H319-H335
Precuationary statements	P261-P305+P351+P338
Siginal words

Certificate of Analysis

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