AG003DBA

533-73-3 | Benzene-1,2,4-triol

AG003DBA

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CAS Number	533-73-3
Catalog Number	AG003DBA(AGN-PC-04RIMQ)
Chemical Name	Benzene-1,2,4-triol
EC Number	208-575-1
IUPAC Name	benzene-1,2,4-triol
InChI	InChI=1S/C6H6O3/c7-4-1-2-5(8)6(9)3-4/h1-3,7-9H
InChI Key	GGNQRNBDZQJCCN-UHFFFAOYSA-N
MDL Number	MFCD00002198
Molecular Formula	C6H6O3
Molecular Weight	126.1100
NSC Number	2818
SMILES	OC1=CC=C(O)C=C1O
UNII	173O8B04RD
Synonyms	1,2,4-benzenetriol, 1,2,4-trihydroxybenzene, hydroxyhydroquinone, hydroxyquinol, 1,2,4-BENZENETRIOL, Benzene-1,2,4-triol, 533-73-3, 1,2,4-Trihydroxybenzene, Hydroxyhydroquinone, Hydroxyquinol, Oxyhydroquinone, 2,5-Dihydroxyphenol, Oxyhydrochinon, Hydroquinone, hydroxy-, 4-Hydroxycatechol, 1,3,4-Trihydroxybenzene, 1,3,4-Benzenetriol, Oxyhydrochinon [German], NSC 2818, UNII-173O8B04RD, CCRIS 2987, EINECS 208-575-1, BRN 2042863, AI3-19361, CHEBI:16971, GGNQRNBDZQJCCN-UHFFFAOYSA-N, 173O8B04RD, MFCD00002198, 1,4-Benzenetriol, Benzene-1,4-triol, 1,4-Trihydroxybenzene, monohydroxy hydroquinone, AC1L1VXZ, WLN: QR BQ DQ, bmse000831, 1,2,4-trihydroxy benzene, AC1Q78MW, ACMC-1B10C, SCHEMBL33527, 2-Hydroxy-1,4-hydroquinone, 2-Hydroxy-p-benzohydroquinone, 4-06-00-07338 (Beilstein Handbook Reference), KSC270C4D, CHEMBL3092389, DTXSID3040930, CTK1H0141, NSC2818, ZINC388437, KS-00000N8X, NSC-2818, ANW-31724, c0264, CT-052, AKOS015889832, AS00200, DS-8585, RTR-018878, TRA0047808, AC-12373, AK164434, AN-45655, CJ-03250, LS-32260, P155, SC-17701, SY004215, ZB011514, AB1008679, DB-018727, TR-018878, 1,2,4-Benzenetriol, ReagentPlus(R), 99%, FT-0606254, 33B733, 8-AMINO-1-NAPHTHOL-3,6-SULPHONIC ACID, C02814, K-9683, MFCD00002198 (95+%), Q-200056, 1,2,4-Benzenetriol, Vetec(TM) reagent grade, 98%, 2,7-NAPHTHALENEDISULFONIC ACID, 4-AMINO-5-HYDROXY, InChI=1/C6H6O3/c7-4-1-2-5(8)6(9)3-4/h1-3,7-9, HQN, H acid, C6H6O3, Benzene- 1, 2, 4- triol, C6-H6-O3, CID10787, 1-Amino-8-naphthol-3,6-disulfonic acid, 1,2,4-Trihydroxybenzene, 99% - 1G 1g, H0249, 1-Amino-8-hydroxynaphthalene-3,6-disulphonic acid, 4-Amino-5-hydroxy-2,7-naphthalenedisulfonic acid, C013038, 105728-90-3, 580-18-7,

Complexity	94.3
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	126.032g/mol
Formal Charge	0
Heavy Atom Count	9
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	3
Isotope Atom Count	0
Molecular Weight	126.111g/mol
Monoisotopic Mass	126.032g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	60.7A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.5

GHS Hazard and Precautionary Statements

Symbol:
Hazard statements	H302-H315-H318-H335
Precuationary statements	P261-P280-P305+P351+P338
Siginal words

Certificate of Analysis

Lot Number