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Oxetanes

Organic heterocyclic compounds that consist of a four-membered ring with three carbon atoms and one oxygen atom.
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1

1-Oxa-6-azaspiro[3.4]octane oxalate, 96%

CAS: 1408074-51-0 Molecular Formula: C8H13NO5 Molecular Weight (g/mol): 203.19 MDL Number: MFCD19982774 InChI Key: ZKTJFOHJBNDMDS-UHFFFAOYNA-N Synonym: 1-oxa-6-azaspiro 3.4 octane oxalate,1-oxa-6-azaspiro 3.4 octane; oxalic acid PubChem CID: 71432930 IUPAC Name: 1-oxa-7-azaspiro[3.4]octane;oxalic acid SMILES: OC(=O)C(O)=O.C1CC2(CCNC2)O1

PubChem CID 71432930
CAS 1408074-51-0
Molecular Weight (g/mol) 203.19
MDL Number MFCD19982774
SMILES OC(=O)C(O)=O.C1CC2(CCNC2)O1
Synonym 1-oxa-6-azaspiro 3.4 octane oxalate,1-oxa-6-azaspiro 3.4 octane; oxalic acid
IUPAC Name 1-oxa-7-azaspiro[3.4]octane;oxalic acid
InChI Key ZKTJFOHJBNDMDS-UHFFFAOYNA-N
Molecular Formula C8H13NO5
2

6-Oxa-1-azaspiro[3.3]heptane hemioxalate, 95%

CAS: 1380571-72-1 Molecular Formula: C12H20N2O6 Molecular Weight (g/mol): 288.3 MDL Number: MFCD22373634 InChI Key: UMKDEMSXCWMHRS-UHFFFAOYSA-N Synonym: 6-oxa-1-azaspiro 3.3 heptane oxalate 2:1,6-oxa-1-azaspiro 3.3 heptane hemioxalate,6-oxa-1-azaspiro 3.3 heptane oxalate 2,bis 6-oxa-1-azaspiro 3.3 heptane oxalate,6-oxa-1-azaspiro 3.3 heptane,ethanedioate 2:1,oxalic acid-6-oxa-1-azaspiro 3.3 heptane 1/2,bis 6-oxa-1-azaspiro 3.3 heptane ; oxalic acid PubChem CID: 71299818 IUPAC Name: 6-oxa-1-azaspiro[3.3]heptane;oxalic acid SMILES: C1CNC12COC2.C1CNC12COC2.C(=O)(C(=O)O)O

PubChem CID 71299818
CAS 1380571-72-1
Molecular Weight (g/mol) 288.3
MDL Number MFCD22373634
SMILES C1CNC12COC2.C1CNC12COC2.C(=O)(C(=O)O)O
Synonym 6-oxa-1-azaspiro 3.3 heptane oxalate 2:1,6-oxa-1-azaspiro 3.3 heptane hemioxalate,6-oxa-1-azaspiro 3.3 heptane oxalate 2,bis 6-oxa-1-azaspiro 3.3 heptane oxalate,6-oxa-1-azaspiro 3.3 heptane,ethanedioate 2:1,oxalic acid-6-oxa-1-azaspiro 3.3 heptane 1/2,bis 6-oxa-1-azaspiro 3.3 heptane ; oxalic acid
IUPAC Name 6-oxa-1-azaspiro[3.3]heptane;oxalic acid
InChI Key UMKDEMSXCWMHRS-UHFFFAOYSA-N
Molecular Formula C12H20N2O6
3

6-Boc-1-oxa-6-azaspiro[3.3]heptane, 96%, Thermo Scientific Chemicals

CAS: 1223573-41-8 Molecular Formula: C10H17NO3 Molecular Weight (g/mol): 199.25 MDL Number: MFCD16877674 InChI Key: QOXFRPSIASGKGE-UHFFFAOYSA-N Synonym: tert-butyl 1-oxa-6-azaspiro 3.3 heptane-6-carboxylate,1-oxa-6-azaspiro 3.3 heptane-6-carboxylic acid tert-butyl ester,6-boc-1-oxa-6-azaspiro 3.3 heptane,tert-butyl2,5-dioxa-8-aza-spiro 3,5 nonane-8-carboxylate,2-aza-5-oxaspiro 3.3 heptane-2-carboxylic acid tert-butyl ester,1-oxa-6-azaspiro 3.3 heptane-6-carboxylic acid,1,1-dimethylethyl ester,tert-butyl 1-oxa-6-azaspiro 3.3 heptane-6-carboxylate 95+% PubChem CID: 54758968 IUPAC Name: tert-butyl 1-oxa-6-azaspiro[3.3]heptane-6-carboxylate SMILES: CC(C)(C)OC(=O)N1CC2(CCO2)C1

PubChem CID 54758968
CAS 1223573-41-8
Molecular Weight (g/mol) 199.25
MDL Number MFCD16877674
SMILES CC(C)(C)OC(=O)N1CC2(CCO2)C1
Synonym tert-butyl 1-oxa-6-azaspiro 3.3 heptane-6-carboxylate,1-oxa-6-azaspiro 3.3 heptane-6-carboxylic acid tert-butyl ester,6-boc-1-oxa-6-azaspiro 3.3 heptane,tert-butyl2,5-dioxa-8-aza-spiro 3,5 nonane-8-carboxylate,2-aza-5-oxaspiro 3.3 heptane-2-carboxylic acid tert-butyl ester,1-oxa-6-azaspiro 3.3 heptane-6-carboxylic acid,1,1-dimethylethyl ester,tert-butyl 1-oxa-6-azaspiro 3.3 heptane-6-carboxylate 95+%
IUPAC Name tert-butyl 1-oxa-6-azaspiro[3.3]heptane-6-carboxylate
InChI Key QOXFRPSIASGKGE-UHFFFAOYSA-N
Molecular Formula C10H17NO3
4

2-Oxa-6-azaspiro[3.3]heptane oxalate, 97%

CAS: 1159599-99-1 Molecular Formula: C7H11NO5 Molecular Weight (g/mol): 189.17 MDL Number: MFCD11976178 InChI Key: KOUVDKDABFOPIG-UHFFFAOYSA-N Synonym: 2-oxa-6-azaspiro 3.3 heptane oxalate,2-oxa-6-aza-spiro 3.3 heptane oxalic acid salt,2-oxa-6-azaspiro 3,3 heptane oxalic acid salt,2-oxa-6-azaspiro 3.3 heptane xoxalate,2-oxa-6-azaspiro 3.3 heptane oxalic acid,2-oxa-6-azaspiro 3.3 heptane; oxalic acid,2-oxa-6-azaspiro 3.3 heptane ethanedioate,2-oxa-6-azaspiro 3.3 heptane oxalate 1:1,2-oxa-6-azaspiro 3.3 heptane, ethanedioate 1:1,acmc-2099rj PubChem CID: 53308464 SMILES: OC(=O)C(O)=O.C1NCC11COC1

PubChem CID 53308464
CAS 1159599-99-1
Molecular Weight (g/mol) 189.17
MDL Number MFCD11976178
SMILES OC(=O)C(O)=O.C1NCC11COC1
Synonym 2-oxa-6-azaspiro 3.3 heptane oxalate,2-oxa-6-aza-spiro 3.3 heptane oxalic acid salt,2-oxa-6-azaspiro 3,3 heptane oxalic acid salt,2-oxa-6-azaspiro 3.3 heptane xoxalate,2-oxa-6-azaspiro 3.3 heptane oxalic acid,2-oxa-6-azaspiro 3.3 heptane; oxalic acid,2-oxa-6-azaspiro 3.3 heptane ethanedioate,2-oxa-6-azaspiro 3.3 heptane oxalate 1:1,2-oxa-6-azaspiro 3.3 heptane, ethanedioate 1:1,acmc-2099rj
InChI Key KOUVDKDABFOPIG-UHFFFAOYSA-N
Molecular Formula C7H11NO5
5

2-(Bromomethyl)oxetane, 96%

CAS: 939759-23-6 Molecular Formula: C4H7BrO Molecular Weight (g/mol): 151.00 MDL Number: MFCD08544405 InChI Key: OMXAGUVERXNCSZ-UHFFFAOYNA-N Synonym: 2-bromomethyl oxetane,2-bromomethyl-oxetane,oxetane, 2-bromomethyl,cyclobutane, bromomethyl,2-bromomethyl oxetane oxetane, 2-bromomethyl PubChem CID: 16244494 IUPAC Name: 2-(bromomethyl)oxetane SMILES: BrCC1CCO1

PubChem CID 16244494
CAS 939759-23-6
Molecular Weight (g/mol) 151.00
MDL Number MFCD08544405
SMILES BrCC1CCO1
Synonym 2-bromomethyl oxetane,2-bromomethyl-oxetane,oxetane, 2-bromomethyl,cyclobutane, bromomethyl,2-bromomethyl oxetane oxetane, 2-bromomethyl
IUPAC Name 2-(bromomethyl)oxetane
InChI Key OMXAGUVERXNCSZ-UHFFFAOYNA-N
Molecular Formula C4H7BrO
6

3-Methyl-3-(p-toluenesulfonyloxymethyl)oxetane, 98%

CAS: 99314-44-0 Molecular Formula: C12H16O4S Molecular Weight (g/mol): 256.316 MDL Number: MFCD08275394 InChI Key: PZOQQSOZRVZCMC-UHFFFAOYSA-N Synonym: 3-methyloxetan-3-yl methyl 4-methylbenzenesulfonate,3-methyl-3-oxetanyl methyl 4-methylbenzenesulfonate,3-methyloxetan-3-yl methyl p-tosylate,3-methyl-3-toluenesulfonyloxymethyl oxetane,3-methyloxetan-3-yl methyl 4-methylbenzene-1-sulfonate,upcmld00wcrh3-139,3-tosyloxymethyl-3-methyloxetane,3-methyl-3-oxetanyl methyl p-tosylate,methyloxetanylmethylmethylbenzenesulfonate,3-methyloxetan-3-yl methyl 4-toluenesulfonate PubChem CID: 5461213 IUPAC Name: (3-methyloxetan-3-yl)methyl 4-methylbenzenesulfonate SMILES: CC1=CC=C(C=C1)S(=O)(=O)OCC2(COC2)C

PubChem CID 5461213
CAS 99314-44-0
Molecular Weight (g/mol) 256.316
MDL Number MFCD08275394
SMILES CC1=CC=C(C=C1)S(=O)(=O)OCC2(COC2)C
Synonym 3-methyloxetan-3-yl methyl 4-methylbenzenesulfonate,3-methyl-3-oxetanyl methyl 4-methylbenzenesulfonate,3-methyloxetan-3-yl methyl p-tosylate,3-methyl-3-toluenesulfonyloxymethyl oxetane,3-methyloxetan-3-yl methyl 4-methylbenzene-1-sulfonate,upcmld00wcrh3-139,3-tosyloxymethyl-3-methyloxetane,3-methyl-3-oxetanyl methyl p-tosylate,methyloxetanylmethylmethylbenzenesulfonate,3-methyloxetan-3-yl methyl 4-toluenesulfonate
IUPAC Name (3-methyloxetan-3-yl)methyl 4-methylbenzenesulfonate
InChI Key PZOQQSOZRVZCMC-UHFFFAOYSA-N
Molecular Formula C12H16O4S
7

2-(Iodomethyl)oxetane, 97%

CAS: 121138-00-9 Molecular Formula: C4H7IO Molecular Weight (g/mol): 198.003 MDL Number: MFCD11226849 InChI Key: JVPHNTROOBLPKR-UHFFFAOYSA-N Synonym: 2-iodomethyl oxetane,oxetane,2-iodomethyl PubChem CID: 49757971 IUPAC Name: 2-(iodomethyl)oxetane SMILES: C1COC1CI

PubChem CID 49757971
CAS 121138-00-9
Molecular Weight (g/mol) 198.003
MDL Number MFCD11226849
SMILES C1COC1CI
Synonym 2-iodomethyl oxetane,oxetane,2-iodomethyl
IUPAC Name 2-(iodomethyl)oxetane
InChI Key JVPHNTROOBLPKR-UHFFFAOYSA-N
Molecular Formula C4H7IO
8

3-Oxetanol, 95%

CAS: 7748-36-9 Molecular Formula: C3H6O2 Molecular Weight (g/mol): 74.08 MDL Number: MFCD09056790 InChI Key: QMLWSAXEQSBAAQ-UHFFFAOYSA-N Synonym: 3-hydroxyoxetane,3-oxetanol,1,3-epoxy-2-propanol,oxetane-3-ol,3-hydroxy-oxetane,3-hydroxy oxetane,pubchem17367,ksc380k3t,1,3-epoxypropan-2-ol PubChem CID: 9942117 IUPAC Name: oxetan-3-ol SMILES: OC1COC1

PubChem CID 9942117
CAS 7748-36-9
Molecular Weight (g/mol) 74.08
MDL Number MFCD09056790
SMILES OC1COC1
Synonym 3-hydroxyoxetane,3-oxetanol,1,3-epoxy-2-propanol,oxetane-3-ol,3-hydroxy-oxetane,3-hydroxy oxetane,pubchem17367,ksc380k3t,1,3-epoxypropan-2-ol
IUPAC Name oxetan-3-ol
InChI Key QMLWSAXEQSBAAQ-UHFFFAOYSA-N
Molecular Formula C3H6O2
9

3-Oxetanone, 95%

CAS: 6704-31-0 Molecular Formula: C3H4O2 Molecular Weight (g/mol): 72.063 MDL Number: MFCD09263255 InChI Key: ROADCYAOHVSOLQ-UHFFFAOYSA-N Synonym: 3-oxetanone,1,3-epoxy-2-propanone,3-oxooxetane,oxetane-3-one,oxetan-3-on,1,3-epoxypropanone,pubchem15880,3-oxentanone,acmc-209nxj,ksc358e8n PubChem CID: 15024254 IUPAC Name: oxetan-3-one SMILES: C1C(=O)CO1

PubChem CID 15024254
CAS 6704-31-0
Molecular Weight (g/mol) 72.063
MDL Number MFCD09263255
SMILES C1C(=O)CO1
Synonym 3-oxetanone,1,3-epoxy-2-propanone,3-oxooxetane,oxetane-3-one,oxetan-3-on,1,3-epoxypropanone,pubchem15880,3-oxentanone,acmc-209nxj,ksc358e8n
IUPAC Name oxetan-3-one
InChI Key ROADCYAOHVSOLQ-UHFFFAOYSA-N
Molecular Formula C3H4O2
10

2-Oxa-6-azaspiro[3.3]heptane 98.0+%, TCI America™

CAS: 174-78-7 Molecular Formula: C5H9NO Molecular Weight (g/mol): 99.133 MDL Number: MFCD12407093 InChI Key: HPJALMWOZYIZGE-UHFFFAOYSA-N PubChem CID: 23111887 IUPAC Name: 2-oxa-6-azaspiro[3.3]heptane SMILES: C1C2(CN1)COC2

PubChem CID 23111887
CAS 174-78-7
Molecular Weight (g/mol) 99.133
MDL Number MFCD12407093
SMILES C1C2(CN1)COC2
IUPAC Name 2-oxa-6-azaspiro[3.3]heptane
InChI Key HPJALMWOZYIZGE-UHFFFAOYSA-N
Molecular Formula C5H9NO
11

3-Amino-3-methyloxetane 97.0+%, TCI America™

CAS: 874473-14-0 Molecular Formula: C4H9NO Molecular Weight (g/mol): 87.122 MDL Number: MFCD11111713 InChI Key: NQVWMPOQWBDSAI-UHFFFAOYSA-N Synonym: 3-methyl-3-oxetanamine,3-amino-3-methyloxetane,3-oxetanamine,3-methyl,3-oxetanamine, 3-methyl,pubchem14416,pubchem23160,acmc-209qnl,3-methyl 3-oxetanamine,3-methyl-3-oxetaneamine,3-amino-3-methyl-oxetane PubChem CID: 46835725 IUPAC Name: 3-methyloxetan-3-amine SMILES: CC1(COC1)N

PubChem CID 46835725
CAS 874473-14-0
Molecular Weight (g/mol) 87.122
MDL Number MFCD11111713
SMILES CC1(COC1)N
Synonym 3-methyl-3-oxetanamine,3-amino-3-methyloxetane,3-oxetanamine,3-methyl,3-oxetanamine, 3-methyl,pubchem14416,pubchem23160,acmc-209qnl,3-methyl 3-oxetanamine,3-methyl-3-oxetaneamine,3-amino-3-methyl-oxetane
IUPAC Name 3-methyloxetan-3-amine
InChI Key NQVWMPOQWBDSAI-UHFFFAOYSA-N
Molecular Formula C4H9NO
12

2-Oxetanemethanol, 96%

CAS: 61266-70-4 Molecular Formula: C4H8O2 Molecular Weight (g/mol): 88.106 MDL Number: MFCD00142933 InChI Key: PQZJTHGEFIQMCO-UHFFFAOYSA-N Synonym: 2-hydroxymethyloxetane,2-oxetanemethanol,2-oxetanylmethanol,2,4-epoxybutanol,oxetan-2-yl-methanol,oxetane-2-methanol,methyloloxacyclobutan,2-hydrpxymethyloxetane,oxetan-2-yl methanol,rac-2-hydroxymethyloxetane PubChem CID: 12284142 IUPAC Name: oxetan-2-ylmethanol SMILES: C1COC1CO

PubChem CID 12284142
CAS 61266-70-4
Molecular Weight (g/mol) 88.106
MDL Number MFCD00142933
SMILES C1COC1CO
Synonym 2-hydroxymethyloxetane,2-oxetanemethanol,2-oxetanylmethanol,2,4-epoxybutanol,oxetan-2-yl-methanol,oxetane-2-methanol,methyloloxacyclobutan,2-hydrpxymethyloxetane,oxetan-2-yl methanol,rac-2-hydroxymethyloxetane
IUPAC Name oxetan-2-ylmethanol
InChI Key PQZJTHGEFIQMCO-UHFFFAOYSA-N
Molecular Formula C4H8O2
13

3-Bromooxetane 95.0+%, TCI America™

CAS: 39267-79-3 Molecular Formula: C3H5BrO Molecular Weight (g/mol): 136.98 MDL Number: MFCD08544402 InChI Key: SZTIZZFKWQWSSP-UHFFFAOYSA-N Synonym: 3-bromo-oxetane,3-bromo oxetane,3-bromanyloxetane,3-bromooxetane,acmc-209j4f,2-bromo-1,3-epoxypropane,5-n,n-dimethylamino-2-hydroxybenzaldehyde PubChem CID: 16244493 IUPAC Name: 3-bromooxetane SMILES: BrC1COC1

PubChem CID 16244493
CAS 39267-79-3
Molecular Weight (g/mol) 136.98
MDL Number MFCD08544402
SMILES BrC1COC1
Synonym 3-bromo-oxetane,3-bromo oxetane,3-bromanyloxetane,3-bromooxetane,acmc-209j4f,2-bromo-1,3-epoxypropane,5-n,n-dimethylamino-2-hydroxybenzaldehyde
IUPAC Name 3-bromooxetane
InChI Key SZTIZZFKWQWSSP-UHFFFAOYSA-N
Molecular Formula C3H5BrO
14

3-Oxetanone 97.0+%, TCI America™

CAS: 6704-31-0 Molecular Formula: C3H4O2 Molecular Weight (g/mol): 72.063 MDL Number: MFCD09263255 InChI Key: ROADCYAOHVSOLQ-UHFFFAOYSA-N Synonym: 3-oxetanone,1,3-epoxy-2-propanone,3-oxooxetane,oxetane-3-one,oxetan-3-on,1,3-epoxypropanone,pubchem15880,3-oxentanone,acmc-209nxj,ksc358e8n PubChem CID: 15024254 IUPAC Name: oxetan-3-one SMILES: C1C(=O)CO1

PubChem CID 15024254
CAS 6704-31-0
Molecular Weight (g/mol) 72.063
MDL Number MFCD09263255
SMILES C1C(=O)CO1
Synonym 3-oxetanone,1,3-epoxy-2-propanone,3-oxooxetane,oxetane-3-one,oxetan-3-on,1,3-epoxypropanone,pubchem15880,3-oxentanone,acmc-209nxj,ksc358e8n
IUPAC Name oxetan-3-one
InChI Key ROADCYAOHVSOLQ-UHFFFAOYSA-N
Molecular Formula C3H4O2
15

3-Oxetanol 96.0+%, TCI America™

CAS: 7748-36-9 Molecular Formula: C3H6O2 Molecular Weight (g/mol): 74.08 MDL Number: MFCD09056790 InChI Key: QMLWSAXEQSBAAQ-UHFFFAOYSA-N Synonym: 3-hydroxyoxetane,3-oxetanol,1,3-epoxy-2-propanol,oxetane-3-ol,3-hydroxy-oxetane,3-hydroxy oxetane,pubchem17367,ksc380k3t,1,3-epoxypropan-2-ol PubChem CID: 9942117 IUPAC Name: oxetan-3-ol SMILES: OC1COC1

PubChem CID 9942117
CAS 7748-36-9
Molecular Weight (g/mol) 74.08
MDL Number MFCD09056790
SMILES OC1COC1
Synonym 3-hydroxyoxetane,3-oxetanol,1,3-epoxy-2-propanol,oxetane-3-ol,3-hydroxy-oxetane,3-hydroxy oxetane,pubchem17367,ksc380k3t,1,3-epoxypropan-2-ol
IUPAC Name oxetan-3-ol
InChI Key QMLWSAXEQSBAAQ-UHFFFAOYSA-N
Molecular Formula C3H6O2