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6-(tert-Butyl)-2,2-dimethyl-2H-benzo[b][1,4]oxazin-3(4H)-one

6-(tert-Butyl)-2,2-dimethyl-2H-benzo[b][1,4]oxazin-3(4H)-one - CAS 1267211-60-8

Name: 6-(tert-Butyl)-2,2-dimethyl-2H-benzo[b][1,4]oxazin-3(4H)-one
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB006643
Product Name:	6-(tert-Butyl)-2,2-dimethyl-2H-benzo[b][1,4]oxazin-3(4H)-one
CAS:	1267211-60-8
Synonyms:	6-tert-butyl-2,2-dimethyl-4H-1,4-benzoxazin-3-one; 6-tert-butyl-2,2-dimethyl-4H-1,4-benzoxazin-3-one

Technical Data

Patents

Computed Properties

IUPAC Name:	6-tert-butyl-2,2-dimethyl-4H-1,4-benzoxazin-3-one
Description:	6-(tert-Butyl)-2,2-dimethyl-2H-benzo[b][1,4]oxazin-3(4H)-one (CAS# 1267211-60-8 ) is a useful research chemical.
Molecular Weight:	233.31
Molecular Formula:	C14H19NO2
Canonical SMILES:	CC1(C(=O)NC2=C(O1)C=CC(=C2)C(C)(C)C)C
InChI:	InChI=1S/C14H19NO2/c1-13(2,3)9-6-7-11-10(8-9)15-12(16)14(4,5)17-11/h6-8H,1-5H3,(H,15,16)
InChI Key:	TVFQHQSNNRTVLO-UHFFFAOYSA-N

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Related Functional Groups

Benzoxazines

[3026594-91-9]C9H10BrFN2O
(S)-8-Bromo-6-fluoro-3-methyl-3,4-dihydro-2H-benzo[b][1,4]oxazin-5-amine
[1780189-83-4]C9H9NO3
5-Methoxy-1H-benzo[d][1,3]oxazin-2(4H)-one
[1514263-64-9]C10H10ClNO2
8-Chloro-2,2-dimethyl-2H-benzo[b][1,4]oxazin-3(4H)-one
[939759-05-4]C8H8ClNO
8-Chloro-3,4-dihydro-2H-1,4-benzoxazine
[154598-52-4]C14H9ClF3NO2
(S)-6-Chloro-4-(cyclopropylethynyl)-4-(trifluoromethyl)-1,4-dihydro-2H-benzo[d][1,3]oxazin-2-one
[103361-99-5]C8H6FNO2
7-Fluoro-2H-1,4-benzoxazin-3(4H)-one

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Publication Number	Title	Priority Date
US-2015031685-A1	Substituted heterocyclic acetamides as kappa opioid receptor (kor) agonists	20120305
US-2011251177-A1	2, 4-pyrimidinediamine compounds and prodrugs thereof and their uses	20100413
US-2011003790-A1	Pyrido [4, 3-d] pyrimidinone derivatives as kinase inhibitors	20080201
US-2011003798-A1	Compounds and compositions as kinase inhibitors	20080201
US-8354526-B2	Pyrido [4, 3-D] pyrimidinone derivatives as kinase inhibitors	20080201

Complexity:	317
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	233.141578849
Formal Charge:	0
Heavy Atom Count:	17
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	233.141578849
Rotatable Bond Count:	1
Topological Polar Surface Area:	38.3
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	3.1