AG002OPL

2460-87-9 | Phenol, 4-(1,1-dimethylethoxy)-

AG002OPL

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CAS Number	2460-87-9
Catalog Number	AG002OPL(AGN-PC-0KKVKD)
Chemical Name	Phenol, 4-(1,1-dimethylethoxy)-
IUPAC Name	4-[(2-methylpropan-2-yl)oxy]phenol
InChI	InChI=1S/C10H14O2/c1-10(2,3)12-9-6-4-8(11)5-7-9/h4-7,11H,1-3H3
InChI Key	CIICLJLSRUHUBY-UHFFFAOYSA-N
MDL Number	MFCD02183556
Molecular Formula	C10H14O2
Molecular Weight	166.2170
SMILES	OC1=CC=C(OC(C)(C)C)C=C1
UNII	4W56A32OU8
Synonyms	4-(tert-Butoxy)phenol, 2460-87-9, 4-tert-Butoxyphenol, p-Tert-butoxyphenol, Phenol, 4-(1,1-dimethylethoxy)-, 4-t-butoxyphenol, UNII-4W56A32OU8, Hydroquinone Mono-tert-butyl Ether, 4-[(2-methylpropan-2-yl)oxy]phenol, 4W56A32OU8, Phenol,4-(1,1-dimethylethoxy)-, MFCD02183556, AK135651, Phenol, p-tert-butoxy-, 4-tert-butoxy-phenol, ACMC-209gdf, AC1MCN7V, SCHEMBL57369, CTK4F4012, DTXSID90179350, CIICLJLSRUHUBY-UHFFFAOYSA-N, KS-000015CG, STR08098, ZINC2578097, ZX-AT003248, 8269AD, ANW-25489, BBL102775, FCH920176, STL556581, AKOS005255235, ACM2460879, MCULE-8841120912, OR10627, PS-3355, AJ-42733, ST094913, AX8100272, ST2405476, TR-011340, B2390, FT-0676514, C-6001, A813756, I14-100370, C10H14O2, CID2773621, 1948-33-0,

Complexity	129
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	166.099g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	166.22g/mol
Monoisotopic Mass	166.099g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	29.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	6.1
Hazard statements	H301-H312-H332
Packing Group	Ⅲ
Precautionary statements	P280-P301+P310
Signal Words	danger
UN Code	UN 2811

Certificate of Analysis

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