AG0032RM

3179-31-5 | 1H-1,2,4-Triazole-3-thiol

AG0032RM

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CAS Number	3179-31-5
Catalog Number	AG0032RM(AGN-PC-0KK00K)
Chemical Name	1H-1,2,4-Triazole-3-thiol
EC Number	221-656-6
IUPAC Name	1,2-dihydro-1,2,4-triazole-3-thione
InChI	InChI=1S/C2H3N3S/c6-2-3-1-4-5-2/h1H,(H2,3,4,5,6)
InChI Key	AFBBKYQYNPNMAT-UHFFFAOYSA-N
MDL Number	MFCD00005229
Molecular Formula	C2H3N3S
Molecular Weight	101.1303
NSC Number	97089
SMILES	n1c[nH]nc1S
UNII	RUS62L885R
Synonyms	1,2,4-triazolethione, mercaptotriazole, 1H-1,2,4-Triazole-3-thiol, 3179-31-5, 3-Mercapto-1,2,4-triazole, 1,2,4-Triazole-3-thiol, Mercaptotriazole, 4H-1,2,4-Triazole-3-thiol, S-Triazole-3-thiol, 3-Mercapto-1H-1,2,4-triazole, 1,2,4-Triazole-5-thiol, 1,3,4-Triazine-2-thiol, 1,3,4-Triazole-2-thiol, 3H-1,2,4-Triazole-3-thione, 1,2-dihydro-, 2-Mercapto-1,3,5-triazole, 5-Mercapto-1,3,4-triazole, ENT 61291, 1,2-Dihydro-3H-1,2,4-triazole-3-thione, 3-Mercapto-4H-1,2,4-triazole, 3(5)-Mercapto-1,2,4-triazole, UNII-RUS62L885R, 1H-1,2,4-Triazole, 3-mercapto-, 2-MERCAPTO-1,3,4-TRIAZOLE, NSC 97089, 1,2,4-Triazol-thiol-(3), 2H-[1,2,4]Triazole-3-thiol, 1,2,4-Triazole-3-thiol (VAN), EINECS 221-656-6, MFCD00005229, 1,2,4-Triazol-thiol-(3) [German], 4H-1,2,4-Triazole-3-thiol (VAN), 1,2-dihydro-1,2,4-triazole-3-thione, AI3-61291, RUS62L885R, 2,3-dihydro-1H-1,2,4-triazole-3-thione, 2,4-dihydro-3H-1,2,4-triazole-3-thione, 1h-[1,2,4]triazole-3-thiol, AFBBKYQYNPNMAT-UHFFFAOYSA-N, 1H-1,2,4-Triazole-3-mercaptan, 1H-1,2,4-TRIAZOLO-3-MERCAPTAN, 2,4-Dihydro-[1,2,4]triazole-3-thione, .DELTA.2-1,2,4-Triazoline-5-thione, 1,4-Triazine-2-thiol, 1,4-Triazole-2-thiol, 1,4-Triazole-3-thiol, 1,4-Triazole-5-thiol, 2-Mercapto-1,4-triazole, 2-Mercapto-1,5-triazole, 3-Mercapto-1,4-triazole, 5-Mercapto-1,4-triazole, ACMC-209hp1, AC1MC3N0, SCHEMBL62313, [1,2,4]triazole-3-thiol, 1H-1,4-Triazole-3-thiol, 3-Mercapto-1,2,4-trizole, 4H-1,4-Triazole-3-thiol, KSC222M1P, 5-mercapto-1,2,4-triazole, 3-mercapto-1h,2,4-triazole, 3-mercaptano-1,2,4-triazole, 3-Mercapto-1H-1,4-triazole, 3-Mercapto-4H-1,4-triazole, 1H-1,2,4-triazol-5-thiol, 3(5)-Mercapto-1,4-triazole, Jsp005909, 3-Thio-1H-1,2,4-triazole, DTXSID0062894, 1H-[1,4]-Triazole-3-thiol, AFBBKYQYNPNMAT-UHFFFAOYSA-, CTK1C2617, CTK8A8516, CTK8A8713, 1H-1,4-Triazole, 3-mercapto-, 4H-[1,2,4]Triazole-3-thiol, 3-Mercapto-[1,2,4]TRIAZOLE, 1H-[1,2,4]-Triazole-3-thiol, 3-Mercapto-4H-[1,2,4]triazole, KS-00000ES5, NSC97089, STR01587, ZINC8619210, ANW-27203, BBL010492, delta2-1,2,4-Triazoline-5-thione, HTS027690, NSC-97089, RW2391, SBB004364, STK386159, STL200174, 1h-1,2,4-triazole-5(4h)-thione, .DELTA.2-1,4-Triazoline-5-thione, 1h-1,2,4-triazol-3-yl hydrosulfide, AKOS000120384, AKOS000271188, AKOS000313121, AKOS000814165, AKOS028108719, 1H-1,2,4-TRIAZOLE-5-THIOL, CS-W013707, MCULE-5875245990, PS-9315, RL03124, RS-0110, RTR-013459, TRA0050939, 1,5-dihydro-1,2,4-triazole-5-thione, 1H-1,2,4-Triazole-3-thiol, 97%, 2,4-dihydro-1,2,4-triazole-3-thione, 3-Mercapto-1H-1,2,4-triazole-1-ide, 1H-1,2,4-Triazol-5-yl hydrosulfide #, AC-24287, AK308496, AN-21757, ST059438, SY036776, AB0010926, AB1008108, DB-048104, LS-156111, TR-013459, 3H-1,4-Triazole-3-thione, 1,2-dihydro-, 4,5-dihydro-1h-1,2,4-triazole-5-thione, delta2-1,2,4-Triazoline-5-thione (8CI), FT-0615942, M0814, AZ0001-0013, MFCD00005229 (97%), K-7470, L-4423, 179M315, AG-690/11353437, I09-0309, J-503787, F1294-0001, F1918-0018, F1918-0058, F9995-0460, InChI=1/C2H3N3S/c6-2-3-1-4-5-2/h1H,(H2,3,4,5,6), 887573-79-7, C2H3N3S, 1,2,4-Triazole-3(5)-thiol, C2-H3-N3-S, CID2723802, 3-Mercapto-1,2,4-triazole, 98% 5g, 3H-1,2,4-triazol-3-tiona, 1,2-dihidro-, 61788-69-0,

Complexity	97
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	101.005g/mol
Formal Charge	0
Heavy Atom Count	6
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	101.127g/mol
Monoisotopic Mass	101.005g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	68.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-0.2

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

Lot Number