1,4-diazepanes

Description:

Diazepanes having the two nitrogen atoms at position 1 and 4 of the diazepane ring.

Ancestors:

Organic compounds ⮕ Organoheterocyclic compounds ⮕ Diazepanes ⮕ 1,4-diazepanes

Popular Products

1-Formylhomopiperazine
CAS: 29053-62-1 PubChem CID: 7006656 Formula: C₆H₁₂N₂O Molecular Weight: 128.18

Liquid ≥98%

In Stock Item #: D710031

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Technical Identifiers

IUPAC Name

1,4-diazepane-1-carbaldehyde

SMILES

C1CNCCN(C1)C=O

InChIKey
RNNVQNMOFQXXTH-UHFFFAOYSA-N

InChI

1S/C6H12N2O/c9-6-8-4-1-2-7-3-5-8/h6-7H,1-5H2

Synonyms
1-Formylhexahydro-1,4-diazepine | Hexahydro-1,4-diazepine-1-carboxaldehyde | Homopiperazine-1-carboxaldehyde
1-Methyl-1，4-diazepan-5-one hydrochloride
CAS: 854828-87-8 PubChem CID: 70700992 Formula: C₆H₁₃ClN₂O Molecular Weight: 164.63

≥95%

Out of Stock Item #: M734830

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IUPAC Name

1-methyl-1,4-diazepan-5-one;hydrochloride

SMILES

CN1CCC(=O)NCC1.Cl

InChIKey
RLLQETHLAUCYJC-UHFFFAOYSA-N

InChI

1S/C6H12N2O.ClH/c1-8-4-2-6(9)7-3-5-8;/h2-5H2,1H3,(H,7,9);1H
1-Ethyl-1,4-diazepane
CAS: 3619-73-6 EC Number: 679-374-8 PubChem CID: 7577538 Formula: C8H17N Molecular Weight: 127.23

Liquid ≥98%

Out of Stock Item #: E710263

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IUPAC Name

1-ethyl-1,4-diazepane

SMILES

CCN1CCCNCC1

InChIKey
CWFLFGDTTKLLGN-UHFFFAOYSA-N

InChI

1S/C7H16N2/c1-2-9-6-3-4-8-5-7-9/h8H,2-7H2,1H3
1-(2-methylpropyl)-1，4-diazepane
CAS: 59039-62-2 PubChem CID: 12236529 Formula: C₉H₂₀N₂ Molecular Weight: 156.27

≥95%

Out of Stock Item #: D726587

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IUPAC Name

1-(2-methylpropyl)-1,4-diazepane

SMILES

CC(C)CN1CCCNCC1

InChIKey
JYVUQGFHFSVKFX-UHFFFAOYSA-N

InChI

1S/C9H20N2/c1-9(2)8-11-6-3-4-10-5-7-11/h9-10H,3-8H2,1-2H3
2-(1,4-Diazepan-1-yl)ethanol
CAS: 53427-65-9 EC Number: 690-011-2 Formula: C₇H₁₆N₂O Molecular Weight: 144.21

Liquid ≥95%

Out of Stock Item #: E700021

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IUPAC Name

2-(1,4-diazepan-1-yl)ethanol

SMILES

C1CNCCN(C1)CCO

InChIKey
IXKNVDAHLCFGCV-UHFFFAOYSA-N

InChI

1S/C7H16N2O/c10-7-6-9-4-1-2-8-3-5-9/h8,10H,1-7H2
1，4-Diazabicyclo[3.2.2]nonane
CAS: 283-38-5 EC Number: 691-399-6 PubChem CID: 398407 Formula: C₇H₁₄N₂ Molecular Weight: 126.2

≥95%

Out of Stock Item #: D690467

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IUPAC Name

1,4-diazabicyclo[3.2.2]nonane

SMILES

C1CN2CCC1NCC2

InChIKey
XJKNACDCUAFDHD-UHFFFAOYSA-N

InChI

1S/C7H14N2/c1-4-9-5-2-7(1)8-3-6-9/h7-8H,1-6H2
tert-butyl 6-(hydroxymethyl)-1,4-diazepane-1-carboxylate
CAS: 1053656-94-2 PubChem CID: 56924603 Formula: C₁₁H₂₂N₂O₃ Molecular Weight: 230.3

≥97%

Out of Stock Item #: T681482

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SMILES

CC(C)(C)OC(=O)N1CCNCC(C1)CO

InChIKey
RZCWERACOAHBGR-UHFFFAOYSA-N

InChI

1S/C11H22N2O3/c1-11(2,3)16-10(15)13-5-4-12-6-9(7-13)8-14/h9,12,14H,4-8H2,1-3H3
(S)-tert-Butyl 2-methyl-1,4-diazepane-1-carboxylate
CAS: 1035226-84-6 EC Number: 962-669-3 PubChem CID: 50999125 Formula: C₁₁H₂₂N₂O₂ Molecular Weight: 214.3

Liquid ≥96%

Out of Stock Item #: T677530

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IUPAC Name

tert-butyl (2S)-2-methyl-1,4-diazepane-1-carboxylate

SMILES

CC1CNCCCN1C(=O)OC(C)(C)C

InChIKey
FPUHWSHGYILARO-VIFPVBQESA-N

InChI

1S/C11H22N2O2/c1-9-8-12-6-5-7-13(9)10(14)15-11(2,3)4/h9,12H,5-8H2,1-4H3/t9-/m0/s1

Synonyms
tert-Butyl (S)-2-methyl-1,4-diazepane-1-carboxylate | (S)-1-Boc-2-Methyl-[1,4]diazepane
tert-butyl (1S,5S)-2,6-diazabicyclo[3.2.0]heptane-6-carboxylate
CAS: 2454490-81-2 PubChem CID: 97290175 Formula: C₁₀H₁₈N₂O₂ Molecular Weight: 198.26

≥97%

Out of Stock Item #: T677968

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Technical Identifiers

SMILES

CC(C)(C)OC(=O)N1C[C@H]2[C@@H]1CCN2

InChIKey
BDVMAANWMDTLFP-YUMQZZPRSA-N

InChI

1S/C10H18N2O2/c1-10(2,3)14-9(13)12-6-7-8(12)4-5-11-7/h7-8,11H,4-6H2,1-3H3/t7-,8-/m0/s1
3-(1,4-diazepan-1-yl)-1λ⁶-thiolane-1,1-dione
CAS: 1019108-04-3 PubChem CID: 43184610 Formula: C₉H₁₈N₂O₂S Molecular Weight: 218.32

≥97%

Out of Stock Item #: T680334

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IUPAC Name

3-(1,4-diazepan-1-yl)thiolane 1,1-dioxide

SMILES

C1CNCCN(C1)C2CCS(=O)(=O)C2

InChIKey
DFMYIAUKUVTSBV-UHFFFAOYSA-N

InChI

1S/C9H18N2O2S/c12-14(13)7-2-9(8-14)11-5-1-3-10-4-6-11/h9-10H,1-8H2
1,4-diazepan-6-ol
CAS: 28795-81-5 PubChem CID: 21114275 Formula: C₅H₁₂N₂O Molecular Weight: 116.16

≥97%

Out of Stock Item #: D677724

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SMILES

C1CNCC(CN1)O
tert-butyl 6-hydroxy-1,4-diazepane-1-carboxylate
CAS: 956317-40-1 PubChem CID: 57690878 Formula: C10H20N2O3

≥97%

Out of Stock Item #: T680484

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IUPAC Name

tert-butyl 6-hydroxy-1,4-diazepane-1-carboxylate

SMILES

CC(C)(C)OC(=O)N1CCNCC(C1)O

InChIKey
GBVLDEOLVSGEJQ-UHFFFAOYSA-N

InChI

1S/C10H20N2O3/c1-10(2,3)15-9(14)12-5-4-11-6-8(13)7-12/h8,11,13H,4-7H2,1-3H3

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