AG003IPU

3383-21-9 | 3,5-Di-tert-butyl-o-benzoquinone

AG003IPU

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CAS Number	3383-21-9
Catalog Number	AG003IPU(AGN-PC-0JLQCP)
Chemical Name	3,5-Di-tert-butyl-o-benzoquinone
EC Number	222-189-0
IUPAC Name	3,5-ditert-butylcyclohexa-3,5-diene-1,2-dione
InChI	InChI=1S/C14H20O2/c1-13(2,3)9-7-10(14(4,5)6)12(16)11(15)8-9/h7-8H,1-6H3
InChI Key	NOUZOVBGCDDMSX-UHFFFAOYSA-N
MDL Number	MFCD00001647
Molecular Formula	C14H20O2
Molecular Weight	220.3074
NSC Number	149061
SMILES	O=C(C(C(C)(C)C)=CC(C(C)(C)C)=C1)C1=O
Synonyms	3,5-di-t-butyl-o-benzoquinone, 3,5-di-tert-butyl-1,2-benzoquinone, 3,5-DTBBQ, 3383-21-9, 3,5-Di-tert-butyl-o-benzoquinone, 3,5-Di-tert-butyl-1,2-benzoquinone, 3,5-di(tert-butyl)benzo-1,2-quinone, 3,5-Cyclohexadiene-1,2-dione, 3,5-bis(1,1-dimethylethyl)-, 3,5-di-tert-butylcyclohexa-3,5-diene-1,2-dione, MFCD00001647, o-Benzoquinone, 3,5-di-tert-butyl-, 3,5-di-tert-butylbenzo-1,2-quinone, NOUZOVBGCDDMSX-UHFFFAOYSA-N, 3,5-di-t-butyl-1,2-benzoquinone, 3,5-Ditert-butylbenzo-1,2-quinone, 3,5-bis(tert-butyl)cyclohexa-3,5-diene-1,2-dione, Benzil-related compound, 54, EINECS 222-189-0, NSC 149061, AC1Q6BRK, 3,5-Ditert-butyl-quinone, AC1L2RY9, cid_76915, MLS000699499, SCHEMBL396841, 3,5-Di-tert-butyl-o-quinone, ACMC-209i34, CHEMBL365161, 3,5-di-t-Butyl-o-benzoquinone, BDBM22775, CTK3J6425, DTXSID70187478, o-Benzoquinone,5-di-tert-butyl-, HMS2618F24, 3,5-di-t-butyl-1,2-dioxobenzene, ALBB-029895, ZINC1734421, ZX-AN080705, ZX-AT021180, ANW-27710, NSC149061, SBB057221, 3,5-ditert-butyl-[1,2]benzoquinone, 3,5-di-tert-Butyl-ortho-benzoquinone, AKOS001667084, MCULE-3451001062, NSC-149061, RP05169, VZ34900, 3,5-Ditert-butylbenzo-1,2-quinone #, NCGC00247199-01, 3,5-Di-tert-butyl-o-benzoquinone, 98%, SC-91340, SMR000226412, RT-003008, 3,2-dione, 3,5-bis(1,1-dimethylethyl)-, D2430, FT-0614738, o-Benzoquinone, 3,5-di-tert-butyl- (8CI), ST50308623, Y8780, 3,5-Bis(tert-butyl)-1,2-benzoquinone 98%, 3,5-ditert-butylcyclohexa-3,5-diene-1,2-dione, AH-188/25003063, 3,5-Bis(tert-butyl)-1,2-dioxocyclohexa-3,5-diene, J-511242, I14-49626, 3,5-Cyclohexadiene-1,2-dione,3,5-bis(1,1-dimethyle, 3,5-Cyclohexadiene-1,2-dione, 3,5-bis(1,1-dimethylethyl)- (9CI), InChI=1/C14H20O2/c1-13(2,3)9-7-10(14(4,5)6)12(16)11(15)8-9/h7-8H,1-6H, D0Z1WQ, C14H20O2, CID76915, AR-1E9808, C14-H20-O2, 3,5-Di-tert-butyl-[1,2]benzoquinone, 3,5-Di-tert-butyl-1,2-benzoquinone, 98% - 1G 1g, 34898-28-7,

Complexity	395
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	220.146g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	220.312g/mol
Monoisotopic Mass	220.146g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	34.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard statements	H302-H315-H319-H335
Precuationary statements	P261-P305+P351+P338
Siginal words

Certificate of Analysis

Lot Number