AG0033FW

2219-82-1 | 2-(tert-Butyl)-6-methylphenol

AG0033FW

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CAS Number	2219-82-1
Catalog Number	AG0033FW(AGN-PC-0JKD0X)
Chemical Name	2-(tert-Butyl)-6-methylphenol
EC Number	218-734-7
IUPAC Name	2-tert-butyl-6-methylphenol
InChI	InChI=1S/C11H16O/c1-8-6-5-7-9(10(8)12)11(2,3)4/h5-7,12H,1-4H3
InChI Key	BKZXZGWHTRCFPX-UHFFFAOYSA-N
MDL Number	MFCD00002239
Molecular Formula	C11H16O
Molecular Weight	164.2441
NSC Number	78461
SMILES	OC1=C(C)C=CC=C1C(C)(C)C
UNII	LT9E3VZD1C
Synonyms	2-tert-Butyl-6-methylphenol, 2219-82-1, 2-(tert-Butyl)-6-methylphenol, 6-tert-Butyl-o-cresol, o-tert-Butyl-o-cresol, 2-Methyl-6-tert-butylphenol, 6-tert-Butyl-2-methylphenol, Phenol, 2-(1,1-dimethylethyl)-6-methyl-, o-Cresol, 6-tert-butyl-, 2-tert-Butyl-6-methyl-phenol, UNII-LT9E3VZD1C, Phenol, 2-tert-butyl-6-methyl-, EINECS 218-734-7, NSC 78461, LT9E3VZD1C, BRN 1862362, CHEMBL29790, AI3-26294, BKZXZGWHTRCFPX-UHFFFAOYSA-N, MFCD00002239, W-109762, NSC78461, t-butylhydroxytoluene, 6-t-butyl-o-cresol, ACMC-209fti, 2-methyl-6-t-butylphenol, 2-t-butyl-6-methylphenol, 2-tertbutyl-6-methylphenol, AC1L28GL, AC1Q2G5K, DSSTox_CID_27468, DSSTox_RID_82368, DSSTox_GSID_47468, SCHEMBL56224, 4-06-00-03396 (Beilstein Handbook Reference), KSC490K6R, DTXSID4047468, CTK3J0568, o-Cresol, 6-tert-butyl- (8CI), Phenol,1-dimethylethyl)-6-methyl-, ZINC1718847, Tox21_302562, 1250AB, ANW-24772, BDBM50409548, NSC-78461, STL453581, 2-tert-Butyl-6-methyl-phenol, 99%, AKOS015890403, FCH1117845, MCULE-4483448704, RTR-010458, TRA0052400, 2-(1,1-dimethylethyl)-6-methylphenol, NCGC00256916-01, AJ-30930, AK-87717, AN-20766, CC-11949, CJ-06844, CJ-29166, CAS-2219-82-1, AX8019459, LS-104172, TR-010458, B0728, FT-0613422, ST24027669, A816009, C-33408, I01-6987, 2-tert-Butyl-6-methyl-phenol, purum, >=98.0% (GC), InChI=1/C11H16O/c1-8-6-5-7-9(10(8)12)11(2,3)4/h5-7,12H,1-4H, C11H16O, CID16678, C11-H16-O,

Complexity	146
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	164.12g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	164.248g/mol
Monoisotopic Mass	164.12g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	20.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.6

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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