AG003KS8

4714-67-4 | 4-Aminobenzothioamide

AG003KS8

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CAS Number	4714-67-4
Catalog Number	AG003KS8(AGN-PC-0WA9ZL)
Chemical Name	4-Aminobenzothioamide
EC Number	610-329-7
IUPAC Name	4-aminobenzenecarbothioamide
InChI	InChI=1S/C7H8N2S/c8-6-3-1-5(2-4-6)7(9)10/h1-4H,8H2,(H2,9,10)
InChI Key	LZJVSPPXXGXGQL-UHFFFAOYSA-N
MDL Number	MFCD00040927
Molecular Formula	C7H8N2S
Molecular Weight	152.2168
NSC Number	18337
SMILES	NC(C1=CC=C(N)C=C1)=S
UNII	RWB1B05E2V
Synonyms	4-Aminothiobenzamide, 4714-67-4, 4-AMINOBENZOTHIOAMIDE, 4-Amino thiobenzamide, 4-Aminobenzenecarbothioamide, p-Aminothiobenzamide, Benzamide, p-aminothio-, p-Aminobenzothiamide, Benzenecarbothioamide, 4-amino-, NSC 18337, 4114-67-4, UNII-RWB1B05E2V, BRN 2802376, RWB1B05E2V, 4-azanylbenzenecarbothioamide, NSC18337, 4-amino-thiobenzamide, AC1MBTUR, 4-amino(thiobenzamide), PubChem13560, ACMC-1ASPB, AC1Q4ZZ6, 4-Aminothiobenzamide, 97%, 3-14-00-01171 (Beilstein Handbook Reference), CHEMBL2441353, SCHEMBL14018619, CTK4I4332, DTXSID40197049, CS-M0715, KS-00001E8G, ZINC5420687, MFCD00040927, NSC-18337, amino(4-aminophenyl)methane-1-thione, AKOS000218303, WLN: ZR DVM2N2&2 &S-O4, AB01833, MCULE-2373377487, VZ35318, Benzenecarbothioamide, 4-amino- (9CI), AS-44307, I320, LS-25669, TC-169087, TL8006919, FT-0692408, ST51042050, EN300-40101, K-9108, A825451, A827161, I09-1467, W-202827, C7H8N2S, C7-H8-N2-S, 4-AMINOBENZENE-1-CARBOTHIOAMIDE, CID2756559,

Complexity	128
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	152.041g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	152.215g/mol
Monoisotopic Mass	152.041g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	84.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H317-H319
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

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