1-Boc-3-azetidinone - CAS 398489-26-4

Name: 1-Boc-3-azetidinone
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB024158
Product Name:	1-Boc-3-azetidinone
CAS:	398489-26-4
Synonyms:	3-oxo-1-azetidinecarboxylic acid tert-butyl ester; tert-butyl 3-oxoazetidine-1-carboxylate

Technical Data

Safety and Hazards

Patents

Literatures

Computed Properties

IUPAC Name:	tert-butyl 3-oxoazetidine-1-carboxylate
Description:	Used for the preparation of antibacterial aminoglycoside analogs.
Molecular Weight:	171.19
Molecular Formula:	C8H13NO3
Canonical SMILES:	CC(C)(C)OC(=O)N1CC(=O)C1
InChI:	InChI=1S/C8H13NO3/c1-8(2,3)12-7(11)9-4-6(10)5-9/h4-5H2,1-3H3
InChI Key:	VMKIXWAFFVLJCK-UHFFFAOYSA-N
Boiling Point:	251.3 °C at 760 mmHg
Density:	1.174 g/cm³
MDL:	MFCD01861741
LogP:	0.74410

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Related Functional Groups

Carbonyl Compounds

[89908-23-6]C23H22N2O5
2-Propenoic acid, 2-(3',3'-dimethyl-6-nitrospiro[2H-1-benzopyran-2,2'-[2H]indol]-1'(3'H)-yl)ethyl ester
[1383427-98-2]C7H13ClN2O2
(S)-Hexahydropyrazino[2,1-c][1,4]oxazin-4(3H)-one hydrochloride
[832741-29-4]C9H11BrOS
1-(4-Bromo-5-propylthiophen-2-yl)ethanone
[956439-56-8]C6H5N3O6
1-(Carboxymethyl)-3-nitro-1H-pyrazole-5-carboxylic acid
[70912-52-6]C10H13NO4
1,3-Dioxane-4,6-dione,2,2-dimethyl-5-(2-pyrrolidinylidene)-
[1431966-64-1]C10H17ClN2O2S
1-{2-[(3-Methoxypropyl)amino]-4-methyl-1,3-thiazol-5-yl}ethanone hydrochloride

Other Building Blocks

[147396-07-4]C10H9NOS
(E)-1-(Benzo[b] thiophen- 2- yl)ethanone Oxime
C50H68O34
Maltotetraose Tridecaacetate
[88563-82-0]C9H11Br
1- (1- Bromoethyl) - 3- methylbenzene
[128076-60-8]C8H8INO
1- (2- Aminophenyl) - 2- iodoethanone
[951987-97-6]C14H13N5O2
N-((4-Oxo-1-phenyl-4,7-dihydro-1H-pyrazolo[3,4-d]pyrimidin-6-yl)methyl)acetamide
[6332-13-4]C9H13NO
4-Aminophenyl Ethyl Carbinol

GHS Hazard Statement:	H302 (97.67%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P310, P312, P321, P330, P332+P313, P362, P403+P233, P405, and P501
Signal Word:	Danger

Publication Number	Title	Priority Date
WO-2021210650-A1	Aryl or heteroaryl derivative	20200416
WO-2021208918-A1	Tricyclic compounds as egfr inhibitors	20200414
WO-2021210857-A1	1,3,4-oxadiazole derivative compounds as histone deacetylase 6 inhibitor, and the pharmaceutical composition comprising the same	20200413
CN-113509557-A	Targeted protease degradation platform (TED)	20200409
WO-2021203007-A1	Substituted 5-hydroxyindole compounds as modulators of alpha-1 antitrypsin	20200403

Complexity:	209
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	171.08954328
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	171.08954328
Rotatable Bond Count:	2
Topological Polar Surface Area:	46.6 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.8