AG003KGO

5384-21-4 | 4,4'-Methylenebis(2,6-dimethylphenol)

AG003KGO

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CAS Number	5384-21-4
Catalog Number	AG003KGO(AGN-PC-0JLRY2)
Chemical Name	4,4'-Methylenebis(2,6-dimethylphenol)
EC Number	226-378-9
IUPAC Name	4-[(4-hydroxy-3,5-dimethylphenyl)methyl]-2,6-dimethylphenol
InChI	InChI=1S/C17H20O2/c1-10-5-14(6-11(2)16(10)18)9-15-7-12(3)17(19)13(4)8-15/h5-8,18-19H,9H2,1-4H3
InChI Key	AZZWZMUXHALBCQ-UHFFFAOYSA-N
MDL Number	MFCD00055640
Molecular Formula	C17H20O2
Molecular Weight	256.3395
NSC Number	128403
SMILES	OC1=C(C)C=C(CC2=CC(C)=C(O)C(C)=C2)C=C1C
Synonyms	4,4'-Methylenebis(2,6-dimethylphenol), 5384-21-4, 4,4'-Methylenedi-2,6-xylenol, Bis(4-hydroxy-3,5-dimethylphenyl)methane, Phenol, 4,4'-methylenebis[2,6-dimethyl-, 4-[(4-hydroxy-3,5-dimethylphenyl)methyl]-2,6-dimethylphenol, Bis(3,5-dimethyl-4-hydroxyphenyl)methane, AZZWZMUXHALBCQ-UHFFFAOYSA-N, Phenol, 4,4'-methylenebis(2,6-dimethyl-, 4,4'-Dihydroxy-3,3',5,5'-tetramethyldiphenylmethane, 4,6-xylenol, 2,6-Xylenol, 4,4'-methylenedi-, EINECS 226-378-9, NSC128403, 4,6-xylenol], 4,6-dimethylphenol), AC1Q2IKC, EC 226-378-9, ACMC-1AL98, SCHEMBL68876, AC1L2X71, AC1Q79J3, CHEMBL593206, DTXSID4063820, AZZWZMUXHALBCQ-UHFFFAOYSA-, 4,4'-Methylenebis[2,6-xylenol], KS-000012MM, ZINC2516104, ANW-31863, MFCD00055640, SBB101757, AKOS015839108, 4,3',5,5'-tetramethyldiphenylmethane, 4,4-methylenebis(2,6-dimethylphenol), MCULE-8100762857, NSC-128403, Phenol,4'-methylenebis[2,6-dimethyl-, 4,4\'-Methylenebis(2,6-dimethylphenol), TR-019027, M1099, 2,2',6,6'-Tetramethyl-4,4'-methylenediphenol, 3,5,5'-Tetramethyl-4,4'-dihydroxydiphenylmethane, AB-131/40897252, 3,3,5,5-Tetramethyl-4,4-dihydroxy-diphenylmethane, W-110030, 3,3',5,5'-Tetramethyl-4,4'-dihydroxydiphenylmethane, 4-(4-hydroxy-3,5-dimethylbenzyl)-2,6-dimethylphenol, InChI=1/C17H20O2/c1-10-5-14(6-11(2)16(10)18)9-15-7-12(3)17(19)13(4)8-15/h5-8,18-19H,9H2,1-4H3, 2, 4,4'-methylenedi-, 4,4'-METHYLENEBIS, CID79345, AR-1F8085, C17-H20-O2, C(c1cc(C)c(O)c(C)c1)c2cc(C)c(O)c(C)c2, 15640-40-1, 54722-86-0,

Complexity	239
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	256.146g/mol
Formal Charge	0
Heavy Atom Count	19
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	256.345g/mol
Monoisotopic Mass	256.146g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	40.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	4.6

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	\N
Hazard statements	H315-H319
Packing Group	\N
Precautionary statements	P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313
UN Code	\N

Certificate of Analysis

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