AG003TD7

3376-24-7 | tert-​Butyl(benzylidene)​amine N-​oxide

AG003TD7

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CAS Number	3376-24-7
Catalog Number	AG003TD7(AGN-PC-0BIRWZ)
Chemical Name	tert-​Butyl(benzylidene)​amine N-​oxide
EC Number	222-168-6
IUPAC Name	N-tert-butyl-1-phenylmethanimine oxide
InChI	InChI=1S/C11H15NO/c1-11(2,3)12(13)9-10-7-5-4-6-8-10/h4-9H,1-3H3/b12-9-
InChI Key	IYSYLWYGCWTJSG-XFXZXTDPSA-N
MDL Number	MFCD00008799
Molecular Formula	C11H17NO
Molecular Weight	179.2588
SMILES	C(=N(O)/C(C)(C)C)c1ccccc1
Synonyms	alpha phenyl-tert-butyl nitrone, alpha-PBN, alpha-phenyl-N-tert-butyl nitrone, alpha-phenyl-t-butyl nitrone, alpha-phenyl-tert-butylnitrone, N-benzylidene-2-methylpropylamine n-oxide, N-t-butyl-alpha-phenylnitrone, N-tert-butyl-alpha-phenylnitrone, N-tert-butylphenylnitrone, phenyl butyl nitrone, phenyl-butyl-nitrone, phenyl-N-tert-butylnitrone, phenyl-N-tert-butylnitrone, (Z)-isomer, phenyl-tert-butylnitrone, n-tert-butyl-alpha-phenylnitrone, 3376-24-7, N-Benzylidene-tert-butylamine N-oxide, alpha-phenyl-tert-butylnitrone, N-tert-butyl-1-phenylmethanimine oxide, Phenyl N-t-butylnitrone, MFCD00008799, n-tert-butyl--phenylnitrone, (Z)-benzylidene(tert-butyl)azane oxide, N-t-Butyl-alpha-phenylnitrone, N-tert-butylphenylnitrone, (Z)-N-Benzylidene-2-methylpropan-2-amine oxide, alpha-Phenyl-N-tert-butylnitrone, alpha-phenyl-N-tert-butyl nitrone, Phenyl-N-tert-butylnitrone, 2-Propanamine, 2-methyl-N-(phenylmethylene)-, N-oxide, alpha-PBN, tert Butylphenylnitrone, phenyl-tert-butylnitrone, N-tert-Butyl-a-phenylnitrone, alpha-Phenyl-t-butylnitrone, alpha-phenyl-t-butyl nitrone, C-Phenyl-N-tert-butylnitrone, N-tert-Butyl-C-phenylnitrone, 2-Phenyl-N-tert-butylnitrone, N-tert-Butyl-2-phenylnitrone, alpha-Phenyl-N-t-butylnitrone, Benzylidene-tert-butylamine N-oxide, EINECS 222-168-6, N-Benzyliden-tert-butylamine N-ether, AC1LCXAE, N-benzylidene-2-methylpropylamine n-oxide, AC1Q1WHY, Phenyl Tert-Butyl Nitrone, n-tert-butyl-n-[(e)-phenylmethylene]amine oxide, CHEMBL13210, 2-Methyl-N-(phenylmethylene)-S-propanamine N-oxide, ZINC5072, DTXSID8040648, N-tert-Butyl-.alpha.-phenylnitrone, AKOS015888338, AKOS025310189, GS-3623, N-tert-Butyl-alpha-phenylnitrone [PBN], amino(tert-butyl)(phenylmethylene)-1-ol, CC-33155, ZB000604, LS-119546, TR-030883, ST51001119, K-7759, C-34741, N-Benzylidene-N-(2-methyl-2-propanyl)amine oxide, J-019319, I01-10313, Nitrone, N-tert-butyl-alpha-phenyl- (6CI,7CI,8CI), F0001-0991, S-Propanamine, 2-methyl-N-(phenylmethylene)-, N-oxide, azane, (1,1-dimethylethyl)(phenylmethylene)-, oxide, (Z)-, InChI=1/C11H15NO/c1-11(2,3)12(13)9-10-7-5-4-6-8-10/h4-9H,1-3H3/b12-9, phenyl-butyl-nitrone, phenyl butyl nitrone, C11H15NO, N-tert-Butyl-?-phenylnitrone, UNII-3I91332OPG, alpha phenyl-tert-butyl nitrone, benzylidene-tert-butylamine oxide, 3-Amino-5-bromo-2-chloropyridine, C11-H15-N-O, AR-1K8197, CID638877, ZINC00005072, phenyl-N-tert-butylnitrone, (Z)-isomer, N-Benzylidene-2-methylpropan-2-amine oxide, B1701, PBN, C029217, N-tert-Butyl-alpha-phenylnitrone, 98% - 1G 1g, 2-Methyl-N-(phenylmethylene)-2-propanamine N-oxide, 6274-20-0,

Complexity	185
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	1
Exact Mass	177.115g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	177.247g/mol
Monoisotopic Mass	177.115g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	28.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number