AG003LJZ

25984-63-8 | 4-Hydroxybenzothioamide

AG003LJZ

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CAS Number	25984-63-8
Catalog Number	AG003LJZ(AGN-PC-0O8CXQ)
Chemical Name	4-Hydroxybenzothioamide
IUPAC Name	4-hydroxybenzenecarbothioamide
InChI	InChI=1S/C7H7NOS/c8-7(10)5-1-3-6(9)4-2-5/h1-4,9H,(H2,8,10)
InChI Key	VDTNKXSVUGXUOJ-UHFFFAOYSA-N
MDL Number	MFCD04973332
Molecular Formula	C7H7NOS
Molecular Weight	153.2016
SMILES	OC1=CC=C(C(=S)N)C=C1
Synonyms	4-Hydroxythiobenzamide, 25984-63-8, 4-hydroxybenzothioamide, 4-hydroxy thiobenzamide, 4-Hydroxybenzene-1-carbothioamide, 4-hydroxybenzenecarbothioamide, BENZENECARBOTHIOAMIDE, 4-HYDROXY-, MFCD04973332, 4-(aminothioxomethyl)phenol, 4-[amino(sulfanyl)methylidene]cyclohexa-2,5-dien-1-one, p-hydroxythiobenzamide, 4-hydroxy-thiobenzamide, 4-hydroxythio-benzamide, PubChem13555, ACMC-209gnx, AC1NWJ5E, SCHEMBL469734, CHEMBL2441358, CTK1A1992, DTXSID40420703, VDTNKXSVUGXUOJ-UHFFFAOYSA-N, HMS1728O12, 4-hydroxythiobenzamide, AldrichCPR, ACT01253, BCP12826, KS-00000LO9, ANW-25867, BBL010014, CH-850, FC0680, SBB066605, STK801400, AKOS000200442, ZINC100003296, AB21285, AC-5907, CS-W018071, GS-3132, MCULE-3501099763, RP18002, RTX-012054, TRA0032488, AJ-39102, AK-21819, AN-10500, BR-21819, CJ-09217, I350, SY030992, AB0005952, DB-001521, ST2411468, TL8006921, A5174, AM20090771, FT-0600967, ST51042056, MFCD04973332 (98%), M-3141, 984H638, A818133, I01-7704, J-515515, 4-[amino(sulfanyl)methylene]cyclohexa-2,5-dien-1-one, Z90124534, 4-[amino(mercapto)methylidene]-1-cyclohexa-2,5-dienone, 4-[azanyl(sulfanyl)methylidene]cyclohexa-2,5-dien-1-one, C7H7NOS, 4-Hydroxythiobenzamide, 98% 5g, ZINC02540612, ACN-001502, CID5706487, 4-Hydroxythiobenzamide, 98% - 25G 25g, H1308,

Complexity	130
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	153.025g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	153.199g/mol
Monoisotopic Mass	153.025g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	78.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.4

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302+H312+H332-H315-H319-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number