Oxazepines

Description:

Compounds containing an oxazepine moiety, which consists of an unsaturated aliphatic seven-member ring with one oxygen atom, a nitrogen atom, and five carbon atoms. Isomers of oxazepine include 1,2-oxazepine, 1,3-oxazepine,and 1,4-oxazepine.

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  1. 1,4-Oxazepane
    CAS: 5638-60-8 EC Number: 816-218-1 Formula: C5H11NO Molecular Weight: 101.149
    Liquid ≥97%
    Out of Stock Item #: H730211
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    Technical Identifiers
    IUPAC Name
    1,4-oxazepane
    SMILES
    C1CNCCOC1
    InChIKey
    ZNGWEEUXTBNKFR-UHFFFAOYSA-N
    InChI
    1S/C5H11NO/c1-2-6-3-5-7-4-1/h6H,1-5H2
    Synonyms
    DTXCID50569935 | hexahydro-1,4-Oxazepine | 1,4-oxazaperhydroepine
  2. 2-(Hydroxymethyl)homomorpholine Hydrochloride
    CAS: 1207194-51-1 PubChem CID: 54579850 Formula: C6H14ClNO2 Molecular Weight: 167.63
    Out of Stock Item #: H733820
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    Technical Identifiers
    IUPAC Name
    1,4-oxazepan-2-ylmethanol;hydrochloride
    SMILES
    C1CNCC(OC1)CO.Cl
    InChIKey
    TYCNWXGJJIVMOT-UHFFFAOYSA-N
    InChI
    1S/C6H13NO2.ClH/c8-5-6-4-7-2-1-3-9-6;/h6-8H,1-5H2;1H
  3. tert-butyl (2S)-2-(hydroxymethyl)-1,4-oxazepane-4-carboxylate
    CAS: 911223-02-4 PubChem CID: 66648764 Formula: C11H21NO4 Molecular Weight: 231.29
    Out of Stock Item #: T681766
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    Technical Identifiers
    SMILES
    CC(C)(C)OC(=O)N1CCCO[C@@H](C1)CO
    InChIKey
    WBAQNCJUTMXJTK-VIFPVBQESA-N
    InChI
    1S/C11H21NO4/c1-11(2,3)16-10(14)12-5-4-6-15-9(7-12)8-13/h9,13H,4-8H2,1-3H3/t9-/m0/s1
  4. 4-[(tert-butoxy)carbonyl]-1,4-oxazepane-2-carboxylic acid
    CAS: 1141669-61-5 PubChem CID: 56972835 Formula: C11H19NO5 Molecular Weight: 245.27
    Out of Stock Item #: O682865
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    IUPAC Name
    4-[(2-methylpropan-2-yl)oxycarbonyl]-1,4-oxazepane-2-carboxylic acid
    SMILES
    CC(C)(C)OC(=O)N1CCCOC(C1)C(=O)O
    InChIKey
    YGITYLFOIAYYJU-UHFFFAOYSA-N
    InChI
    1S/C11H19NO5/c1-11(2,3)17-10(15)12-5-4-6-16-8(7-12)9(13)14/h8H,4-7H2,1-3H3,(H,13,14)
  5. tert-butyl 6-formyl-1,4-oxazepane-4-carboxylate
    CAS: 1269755-59-0 PubChem CID: 71742289 Formula: C11H19NO4 Molecular Weight: 229.27
    Out of Stock Item #: T681498
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    Technical Identifiers
    SMILES
    CC(C)(C)OC(=O)N1CCOCC(C1)C=O
    InChIKey
    URPNDUJBEFQVLM-UHFFFAOYSA-N
    InChI
    1S/C11H19NO4/c1-11(2,3)16-10(14)12-4-5-15-8-9(6-12)7-13/h7,9H,4-6,8H2,1-3H3
  6. tert-butyl (6R)-6-amino-1,4-oxazepane-4-carboxylate
    CAS: 1932141-27-9 PubChem CID: 44119210 Formula: C10H20N2O3 Molecular Weight: 216.28
    Out of Stock Item #: T678925
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    Technical Identifiers
    SMILES
    CC(C)(C)OC(=O)N1CCOCC(C1)N
    InChIKey
    QIAURBVQLIUTQH-UHFFFAOYSA-N
    InChI
    1S/C10H20N2O3/c1-10(2,3)15-9(13)12-4-5-14-7-8(11)6-12/h8H,4-7,11H2,1-3H3
  7. 6-fluoro-1,4-oxazepane;hydrochloride
    CAS: 218594-82-2 PubChem CID: 22342962 Formula: C5H11ClFNO Molecular Weight: 155.6
    Out of Stock Item #: F683031
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    Technical Identifiers
    SMILES
    C1COCC(CN1)F.Cl
    InChIKey
    MSXZNRACJKKNCL-UHFFFAOYSA-N
    InChI
    1S/C5H10FNO.ClH/c6-5-3-7-1-2-8-4-5;/h5,7H,1-4H2;1H
  8. tert-butyl N-[(6R)-1,4-oxazepan-6-yl]carbamate
    CAS: 2306245-70-3 PubChem CID: 124668670 Formula: C10H20N2O3 Molecular Weight: 216.28
    Out of Stock Item #: T632567
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    Technical Identifiers
    IUPAC Name
    tert-butyl N-[(6R)-1,4-oxazepan-6-yl]carbamate
    SMILES
    CC(C)(C)OC(=O)NC1CNCCOC1
    InChIKey
    ZKGJDFARDRHXIQ-MRVPVSSYSA-N
    InChI
    1S/C10H20N2O3/c1-10(2,3)15-9(13)12-8-6-11-4-5-14-7-8/h8,11H,4-7H2,1-3H3,(H,12,13)/t8-/m1/s1
    Synonyms
    2306245-70-3 | tert-butyl N-[(6R)-1,4-oxazepan-6-yl]carbamate | (R)-tert-Butyl 1,4-oxazepan-6-ylcarbamate | SCHEMBL23...
  9. tert-butyl N-[(6S)-1,4-oxazepan-6-yl]carbamate
    CAS: 2306247-11-8 PubChem CID: 124668671 Formula: C10H20N2O3 Molecular Weight: 216.28
    Out of Stock Item #: T632579
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    Technical Identifiers
    IUPAC Name
    tert-butyl N-[(6S)-1,4-oxazepan-6-yl]carbamate
    SMILES
    CC(C)(C)OC(=O)NC1CNCCOC1
    InChIKey
    ZKGJDFARDRHXIQ-QMMMGPOBSA-N
    InChI
    1S/C10H20N2O3/c1-10(2,3)15-9(13)12-8-6-11-4-5-14-7-8/h8,11H,4-7H2,1-3H3,(H,12,13)/t8-/m0/s1
    Synonyms
    2306247-11-8 | tert-butyl N-[(6S)-1,4-oxazepan-6-yl]carbamate | (S)-tert-Butyl 1,4-oxazepan-6-ylcarbamate | SCHEMBL22...
  10. tert-butyl N-(1,4-oxazepan-6-yl)carbamate
    CAS: 1782916-90-8 EC Number: 816-605-5 PubChem CID: 84076244 Formula: C10H20N2O3 Molecular Weight: 216.28
    Out of Stock Item #: T630398
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    Technical Identifiers
    IUPAC Name
    tert-butyl N-(1,4-oxazepan-6-yl)carbamate
    SMILES
    CC(C)(C)OC(=O)NC1CNCCOC1
    InChIKey
    ZKGJDFARDRHXIQ-UHFFFAOYSA-N
    InChI
    1S/C10H20N2O3/c1-10(2,3)15-9(13)12-8-6-11-4-5-14-7-8/h8,11H,4-7H2,1-3H3,(H,12,13)
    Synonyms
    6-(Boc-amino)-1,4-oxazepane | (S)-N-Boc-1,4-oxazepan-6-amine | tert-Butyl (1,4-oxazepan-6-yl)carbamate | P18061 | ter...
  11. tert-butyl 8-oxa-2,5-diazaspiro[3.6]decane-2-carboxylate
    CAS: 1251005-80-7 PubChem CID: 72207340 Formula: C12H22N2O3 Molecular Weight: 242.32
    Out of Stock Item #: T627752
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    Technical Identifiers
    IUPAC Name
    tert-butyl 8-oxa-2,5-diazaspiro[3.6]decane-2-carboxylate
    SMILES
    CC(C)(C)OC(=O)N1CC2(C1)CCOCCN2
    InChIKey
    REOANICIPSIKJM-UHFFFAOYSA-N
    InChI
    1S/C12H22N2O3/c1-11(2,3)17-10(15)14-8-12(9-14)4-6-16-7-5-13-12/h13H,4-9H2,1-3H3
    Synonyms
    2-BOC-8-OXA-2,5-DIAZA-SPIRO[3.6]DECANE | 1251005-80-7 | TERT-BUTYL 8-OXA-2,5-DIAZASPIRO[3.6]DECANE-2-CARBOXYLATE | BA...
  12. tert-butyl (2R)-2-(hydroxymethyl)-1,4-oxazepane-4-carboxylate
    CAS: 911223-23-9 PubChem CID: 66648993 Formula: C11H21NO4 Molecular Weight: 231.29
    Out of Stock Item #: T635083
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    Technical Identifiers
    IUPAC Name
    tert-butyl (2R)-2-(hydroxymethyl)-1,4-oxazepane-4-carboxylate
    SMILES
    CC(C)(C)OC(=O)N1CCCOC(C1)CO
    InChIKey
    WBAQNCJUTMXJTK-SECBINFHSA-N
    InChI
    1S/C11H21NO4/c1-11(2,3)16-10(14)12-5-4-6-15-9(7-12)8-13/h9,13H,4-8H2,1-3H3/t9-/m1/s1
    Synonyms
    SCHEMBL306580 | tert-butyl (2R)-2-(hydroxymethyl)-1,4-oxazepane-4-carboxylate | DTXSID501130316 | (R)-4-tert-butyloxy...
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