AG003FN7

83-30-7 | 2,4,6-Trihydroxybenzoic acid

AG003FN7

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CAS Number	83-30-7
Catalog Number	AG003FN7(AGN-PC-0JL77G)
Chemical Name	2,4,6-Trihydroxybenzoic acid
EC Number	201-467-5
IUPAC Name	2,4,6-trihydroxybenzoic acid
InChI	InChI=1S/C7H6O5/c8-3-1-4(9)6(7(11)12)5(10)2-3/h1-2,8-10H,(H,11,12)
InChI Key	IBHWREHFNDMRPR-UHFFFAOYSA-N
MDL Number	MFCD00002453
Molecular Formula	C7H6O5
Molecular Weight	170.1195
NSC Number	36720
SMILES	C(=O)(O)c1c(O)cc(cc1O)O
UNII	3NC0UQ5EMR
Synonyms	2,4,6-trihydroxybenzoic acid, sodium 2,4,6-trihydroxybenzoate, 2,4,6-Trihydroxybenzoic acid, 83-30-7, Phloroglucinic acid, Phloroglucinol carboxylic acid, Benzoic acid, 2,4,6-trihydroxy-, Phloroglucincarboxylic acid, Phloroglucinolcarboxylic acid, 2,4,6-Trihydroxybenzene carboxylic acid, UNII-3NC0UQ5EMR, EINECS 201-467-5, NSC 36720, 3NC0UQ5EMR, BRN 2212148, AI3-15973, 2,4,6-Trichydroxybenzoic acid, IBHWREHFNDMRPR-UHFFFAOYSA-N, AK-44114, AE-562/43341371, W-104148, 2,4,6-Trihydroxybenzoicacid, 2,4,6-Trihydroxy benzoic acid, PGCA, 2,6-Trihydroxybenzoic acid, WLN: QVR BQ DQ FQ, 2,6-Trihydroxy benzoic acid, 4-10-00-01987 (Beilstein Handbook Reference), SCHEMBL180437, Benzoic acid,4,6-trihydroxy-, AC1L25K0, 2,4,6- trihydroxybenzoic acid, 2,4,6-trihydroxy-benzoic acid, CHEMBL3747578, DTXSID1058890, CTK5F0595, KS-00000JPV, 2,4, 6-Trihydroxy benzoic acid, BDBM108031, ZINC389778, 2,4,6-tris(oxidanyl)benzoic acid, NSC36720, ANW-44413, FCH095660, MFCD00002453, NSC-36720, SBB058332, 2,4,6-trihydroxybenzoic acid (M3), 2,6-Trihydroxybenzene carboxylic acid, AKOS009158439, DS-2070, LS11467, MCULE-9873907838, TRA0023981, AJ-20943, AN-42250, LS-38398, AX8022781, ST2403646, TC-133158, 4CH-018386, FT-0609877, P0601, ST51016228, A840556, S01-0186, Acetylphloroglucinol, 2,4,6-trihydroxybenzoesyre, C7H6O5, C7-H6-O5, CID66520, 2,4,6-trihydroxybenzoic acid hydrate, 2,4,6-Trihydroxybenzoic acid monohydrate, 71989-93-0, 106-46-7,

Complexity	169
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	170.022g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	4
Isotope Atom Count	0
Molecular Weight	170.12g/mol
Monoisotopic Mass	170.022g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	98A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.8

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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