AG003KJX

497-39-2 | 2,4-Di-tert-butyl-5-methylphenol

AG003KJX

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CAS Number	497-39-2
Catalog Number	AG003KJX(AGN-PC-0JK9IG)
Chemical Name	2,4-Di-tert-butyl-5-methylphenol
EC Number	207-847-7
IUPAC Name	2,4-ditert-butyl-5-methylphenol
InChI	InChI=1S/C15H24O/c1-10-8-13(16)12(15(5,6)7)9-11(10)14(2,3)4/h8-9,16H,1-7H3
InChI Key	WYSSJDOPILWQDC-UHFFFAOYSA-N
MDL Number	MFCD00059208
Molecular Formula	C15H24O
Molecular Weight	220.3505
SMILES	OC1=CC(C)=C(C(C)(C)C)C=C1C(C)(C)C
UNII	TMY866FL30
Synonyms	4,6-Di-tert-butyl-m-cresol, 497-39-2, DBMC, 2,4-Di-tert-butyl-5-methylphenol, 4,6-Di-t-butyl-m-cresol, 4,6-DI-TERT-BUTYL-3-METHYLPHENOL, Di-tert-butyl-m-cresol, 2,4-Di-t-butyl-5-methylphenol, m-Cresol, 4,6-di-tert-butyl-, UNII-TMY866FL30, Phenol, 2,4-bis(1,1-dimethylethyl)-5-methyl-, HSDB 5669, 2,4-Ditert-butyl-5-methylphenol, 3-Methyl-4,6-di-tert-butylphenol, EINECS 207-847-7, BRN 2094885, AI3-15481, TMY866FL30, 2,4-Bis(1,1-dimethylethyl)-5-methylphenol, W-109082, ACMC-209khy, Phenol,2,4-bis(1,1-dimethylethyl)-5-methyl-, AC1Q1MF3, DSSTox_CID_21502, DSSTox_RID_79753, DSSTox_GSID_41502, 4-06-00-03510 (Beilstein Handbook Reference), SCHEMBL824520, AC1L1V08, AC1Q2J73, CHEMBL3183034, DTXSID1041502, CTK8B1753, WYSSJDOPILWQDC-UHFFFAOYSA-N, 2,4-ditert-butyl-5-methyl-phenol, ZINC2040443, Tox21_301524, 2,4-Di-tert-butyl-5-hydroxytoluene, 2,4-Ditert-butyl-5-methylphenol #, 6295AF, ANW-30836, MFCD00059208, AKOS015890396, VZ27595, KS-00000W57, NCGC00255488-01, AJ-33231, AN-45326, CAS-497-39-2, CC-17417, CJ-32382, LS-55369, AX8016174, DB-051683, TC-119581, D1432, FT-0632231, 5-Methyl-2,4-bis(2-methyl-2-propanyl)phenol, C-12208, I01-6990, InChI=1/C15H24O/c1-10-8-13(16)12(15(5,6)7)9-11(10)14(2,3)4/h8-9,16H,1-7H, Di-t-butyldichlorotin, C15H24O, m-Cresol, 4,6,-di-tert-butyl-, CID10346, AR-1I3481, C15-H24-O, 19429-30-2, 51839-16-8,

Complexity	231
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	220.183g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	220.356g/mol
Monoisotopic Mass	220.183g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	20.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	5.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319
Packing Group
Precautionary statements	P264-P270-P280-P301+P312+P330-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313-P501
Signal Words	warning
UN Code

Certificate of Analysis

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