AG003FNU

527-60-6 | 2,4,6-Trimethylphenol

AG003FNU

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CAS Number	527-60-6
Catalog Number	AG003FNU(AGN-PC-0JK9NQ)
Chemical Name	2,4,6-Trimethylphenol
EC Number	208-419-2
FEMA Number	4329
IUPAC Name	2,4,6-trimethylphenol
InChI	InChI=1S/C9H12O/c1-6-4-7(2)9(10)8(3)5-6/h4-5,10H,1-3H3
InChI Key	BPRYUXCVCCNUFE-UHFFFAOYSA-N
MDL Number	MFCD00002235
Molecular Formula	C9H12O
Molecular Weight	136.1910
SMILES	OC1=C(C)C=C(C)C=C1C
UNII	FPZ32614N6
Synonyms	2,4,6-trimethylphenol, 2,4,6-TRIMETHYLPHENOL, 527-60-6, Mesitol, Mesityl alcohol, Phenol, 2,4,6-trimethyl-, 2-Hydroxymesitylene, 2,4,6-Trimetylofenol, 1,3,5-Trimethylphenol, 2,4,6-Trimethyl-phenol, 1-Hydroxy-2,4,6-trimethylbenzene, 2,4,6-Trimethylofenol, UNII-FPZ32614N6, HSDB 5677, 2,4,6-Trimetylofenol [Polish], 2,4,6-Trimethylofenol [Polish], NSC 5353, EINECS 208-419-2, 2,4,6-trimethyl phenol, Benzene, 2-hydroxy-1,3,5-trimethyl-, BRN 1859675, BPRYUXCVCCNUFE-UHFFFAOYSA-N, FPZ32614N6, MFCD00002235, 2,6-Trimethylphenol, Phenol,4,6-trimethyl-, BENZENE,1-HYDROXY,2,4,6-TRIMETHYL, DSSTox_CID_2049, DSSTox_RID_76468, DSSTox_GSID_22049, F3308-0308, 1-Hydroxy-2,6-trimethylbenzene, 2,4,6-Trimethylphenol, 99%, CAS-527-60-6, Hydroxymesitylene, PubChem21744, 2,4, 6-Trimethylphenol, ACMC-1B1EE, 2, 4, 6-trimethylphenol, AC1L1VR8, AC1Q2I7Z, SCHEMBL36529, 4-06-00-03253 (Beilstein Handbook Reference), CHEMBL108930, DTXSID7022049, 2,4,6-Trimethylphenol, 97%, CTK3J8090, NSC5353, ZINC967332, BCP11227, NSC-5353, NSC68321, Tox21_202252, Tox21_300348, 2-Hydroxy-1,3,5-trimethyl-Benzene, ANW-31540, NSC-68321, SBB085943, 2,4,6-Trimethylphenol, 99%, FG, AKOS000121003, ZINC113015994, AS04588, CM11813, FS-4819, MCULE-3207067322, NE10159, KS-00000W22, NCGC00248001-01, NCGC00248001-02, NCGC00254453-01, NCGC00259801-01, AJ-24462, AK153077, AN-23538, BP-10776, L057, LS-89873, SY049486, ZB015394, 2,4,6-Trimethylphenol, analytical standard, RT-004231, FT-0628232, ST50456257, MFCD00002235 (97%), A829237, AC-907/25014259, I01-6873, W-105800, 2,4,6-Trimethylphenol, PESTANAL(R), analytical standard, 2,4,6-Trimethylphenol, certified reference material, TraceCERT(R), InChI=1/C9H12O/c1-6-4-7(2)9(10)8(3)5-6/h4-5,10H,1-3H, 2,3,4-Trimethylphenol, Phenol, 2,4,6-teimethyl-, C9H12O, C9-H12-O, CID10698, T0486, 2,4,6-Trimethylphenol (<lt/> 100 microg/ml) in cyclohexane,

Complexity	99.3
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	136.089g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	136.194g/mol
Monoisotopic Mass	136.089g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	20.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	8
Hazard statements	H314
Packing Group	Ⅲ
Precautionary statements	P280-P305+P351+P338-P310
UN Code	UN 2430

Certificate of Analysis

Lot Number