AG001DLW

1460-02-2 | Benzene, 1,3,5-tris(1,1-dimethylethyl)-

AG001DLW

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CAS Number	1460-02-2
Catalog Number	AG001DLW(AGN-PC-0JKC37)
Chemical Name	Benzene, 1,3,5-tris(1,1-dimethylethyl)-
EC Number	215-952-4
IUPAC Name	1,3,5-tritert-butylbenzene
InChI	InChI=1S/C18H30/c1-16(2,3)13-10-14(17(4,5)6)12-15(11-13)18(7,8)9/h10-12H,1-9H3
InChI Key	GUFMBISUSZUUCB-UHFFFAOYSA-N
MDL Number	MFCD00008831
Molecular Formula	C18H30
Molecular Weight	246.4308
SMILES	C(C)(C)(C)c1cc(C(C)(C)C)cc(c1)C(C)(C)C
Synonyms	1,3,5-Tri-tert-butylbenzene, 1460-02-2, Benzene, 1,3,5-tris(1,1-dimethylethyl)-, 1,3,5-Tri-t-butylbenzene, 1,3,5-tritert-butylbenzene, Benzene, 1,3,5-tri-tert-butyl-, 1,3,5-tris(tert-butyl)benzene, GUFMBISUSZUUCB-UHFFFAOYSA-N, MFCD00008831, AK-50687, J-503853, EINECS 215-952-4, PubChem13719, AI3-28799, Intermediates-ZCF02115, ACMC-209cw6, KSC490M7L, 1,3,5-tritert-butyl-benzene, AC1L254T, 1,3,5-tri(tertbutyl) benzene, 1,3,5-tri-tert-butyl-benzene, CTK3J0675, DTXSID50163255, KS-00000LY9, ZINC2077478, ZX-AT021905, 1,3,5-Tri-tert-butylbenzene-2-D, ANW-20980, WT1916, 1,3,5-Tri-tert-butylbenzene, 97%, AKOS015838111, AN-6119, AS05739, CM12297, EBD2219258, FR-0757, MCULE-7310807056, OR17927, RL01836, RTR-005767, TRA0025729, 1,3,5-Tris-(1,1-dimethylethyl)benzene, AJ-33478, AS-15394, BR-50687, CC-03035, CJ-07734, CJ-32783, P167, SC-90457, SY019084, SY246301, AB0016855, AX8053694, ST2402968, TR-005767, 1460-02-2 1,3,5-tri-tert-butylbenzene, AM20030001, FT-0606532, ST50406478, MFCD09869418 (95%), A25388, M-1631, MFCD00008831 (97+%), AB-131/40897118, C-34757, I14-8111, 1,3,5-Tris-(1,1-dimethylethyl)benzene;Benzene, 1,3,5-tris(1,1-dimethylethyl)-;benzene,1,3,5-tri(1,1-dimethylethyl)-, 107396-03-2, InChI=1/C18H30/c1-16(2,3)13-10-14(17(4,5)6)12-15(11-13)18(7,8)9/h10-12H,1-9H, CID15089, C18H30, ZINC02077478, ACN-036921, C18-H30, T1633, 1,3,5-Tri-tert-butylbenzene, 98% - 1G 1g,

Complexity	206
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	246.235g/mol
Formal Charge	0
Heavy Atom Count	18
Hydrogen Bond Acceptor Count	0
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	246.438g/mol
Monoisotopic Mass	246.235g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	0A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	6.9

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number