Basic information
- CAS
5834-63-9- Standard SMILES
O=C1CCCCCNC(=O)CCCCCNC(=O)CCCCCNC(=O)CCCCCN1- InChIKey
LAIGWNLGTIDKPL-UHFFFAOYSA-N- Molecular formula
- C24H44N4O4
- Average molar mass
- 452.6 g/mol
- Monoisotopic mass
- 452.3362559
Overview
1,8,15,22-Tetraazacyclooctacosane-2,9,16,23-tetrone is a carboximidic acid.
Names & identifiers
- Preferred name
- 1,8,15,22-Tetraazacyclooctacosane-2,9,16,23-tetrone
- IUPAC
- 1,8,15,22-tetrazacyclooctacosane-2,9,16,23-tetrone
- English name
- 1,8,15,22-tetrazacyclooctacosane-2,9,16,23-tetrone
- Molecular formula
- C24H44N4O4
- Molecular weight
- 452.63
Names & synonyms
5834-63-91,8,15,22-Tetraazacyclooctacosane-2,9,16,23-tetroneDTXSID00207072RefChem:221738DTXCID001295631,8,15,22-tetrazacyclooctacosane-2,9,16,23-tetrone1,8,15,22-Tetraazacyclooctacosane-2,9,16,23-tetraone1,8,15,22-Tetraazacyclononacosane-2,9,16,23-tetronePA 6 TETRAMERCaprolactam Cyclic TetramerCyclic Tetramer of Caprolactam1,8,15,22-Tetraaza-2,9,16,23-cyclooctacosanetetrone
Show more names
Caprolactam TetramerCaprolactam ImpurityCaprolactam Impurity 1Plerixafor Impurity 751,8,15,22-Tetraaza-2,9,16,23-cyclooctacosanetetraone
SCHEMBL30444313CHEBI:189206LAIGWNLGTIDKPL-UHFFFAOYSA-Npolyamide (hexa) - cyclic, n=4FAA83463MFCD21604643AS-83188DB-225993
Database identifiers
- CAS
5834-63-9
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 116 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 0
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 458
Physicochemical properties
- Melting point
- 256 · 256-257 °C
- Boiling point
- 810.6 · 810.6±65.0 °C(Predicted)
- Density
- 0.969 · 0.969±0.06 g/cm3(Predicted)
- solubility
- DMSO (Slightly), Methanol (Slightly)
- form
- Solid
- pka
- 15.76 · 15.76±0.20(Predicted)
- color
- Off-White to Light Brown
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Applications
Uses1,8,15,22-Tetraazacyclononacosane-2,9,16,23-tetrone is used in biological study as a metabolite of Corynebacterium Aurantiacum.
Suppliers9 total
湖北瑞玛标物科技有限公司15787879035 15787875101 · [email protected]
梯希爱（上海）化工贸易有限公司021-61109150 · [email protected]
TLC梯尔希（南京）药物研发有限公司18012923235 · [email protected]
艾吉析科技（上海）有限公司17717235263 17717235263 · [email protected]
成都标样生物科技有限公司028-81700200 13308200041 · [email protected]
湖北扬信医药科技有限公司15374522761 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 15955137747 · [email protected]
上海凯为化学科技有限公司021-58461859 15821823057 · [email protected]
上海传芊化工科技中心15869524721 · [email protected]
Additional notes
DefinitionChEBI: 1,8,15,22-Tetraazacyclooctacosane-2,9,16,23-tetrone is a carboximidic acid.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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