Basic information
- CAS
5409-42-7- Standard SMILES
C1CNC2NCCNC2N1- InChIKey
HQJLFRMMLKYIJX-UHFFFAOYSA-N- Molecular formula
- C6H14N4
- Average molar mass
- 142.2 g/mol
- Monoisotopic mass
- 142.12184646
Names & identifiers
- Preferred name
- Decahydropyrazino(2,3-b)pyrazine
- IUPAC
- 1,2,3,4,4a,5,6,7,8,8a-decahydropyrazino[2,3-b]pyrazine
- English name
- Decahydro-pyrazino[2,3-b]pyrazine
- Molecular formula
- C6H14N4
- Molecular weight
- 142.2
Names & synonyms
Decahydropyrazino[2,3-b]pyrazine5409-42-7Decahydropyrazino(2,3-b)pyrazinePyrazino(2,3-b)pyrazine, decahydro-Pyrazino[2,3-b]pyrazine, decahydro-6R32W5C4SBCYMAX CURATIVE PEINECS 226-479-8NSC 12462NSC-12462DTXSID70638451,4,5,8-TETRAAZAPERHYDRONAPHTHALENE
Show more names
TIMTEC-BB SBB010123Decahydro-pyrazino[2,3-b]pyrazine, 98 %
RefChem:585330DTXCID8041587226-479-8Decahydro-pyrazino[2,3-b]pyrazine1,4,5,8-Tetraazadecalin1,2,3,4,4a,5,6,7,8,8a-decahydropyrazino[2,3-b]pyrazineDECAHYDRO-[1,4]DIAZINO[2,3-B]PYRAZINEMFCD00023884
Database identifiers
- CAS
5409-42-7- PubChem CID
- 79418
- DTXSID
DTXSID7063845- ChEMBL
CHEMBL1723137- UNII
- 6R32W5C4SB
- EC Number
- 226-479-8
- Nikkaji
- J1.689.383H、J217.975J
Properties
Computed structural properties
- XLogP
- -1.6
- Topological polar surface area
- 48.1 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 0
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 90.3
Experimental & physicochemical properties
SpringerMaterials Properties15N nuclear magnetic resonance spectrum
Physicochemical properties
- Melting point
- 180 · 180-210°C
- Boiling point
- 272.4 · 272.4±8.0 °C(Predicted)
- Density
- 0.997 · 0.997±0.06 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C
- pka
- 10.47 · 10.47±0.20(Predicted)
- FDA UNII
- 6 R32W5C4SB · 6R32W5C4SB
- EPA Substance Registry System
- 2 · Pyrazino[2,3-b]pyrazine, decahydro- (5409-42-7)
- Symbol(GHS)
- 8 · GHS08
- Signal word
- Danger
- Hazard statements
- 317 · H317-H315-H319-H334
- Precautionary statements
- 264 · P264-P280-P302+P352-P321-P332+P313-P362-P261-P272-P280-P302+P352-P333+P313-P321-P363-P501-P264-P280-P305+P351+P338-P337+P313P-P261-P285-P304+P341-P342+P311-P501
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Danger
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P233, P260, P261, P264, P264+P265, P270, P271, P272, P280, P284, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P321, P330, P332+P317, P333+P317, P337+P317, P342+P316, P362+P364, P403, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 9 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- tsca
- TSCA listed
- risk_code
- 36/37/38
- Signal word
- Danger
- Symbol(GHS)
- GHS08
- hazard_code
- Xi
- safety_code
- 26-36/37/39
- hazard_class
- IRRITANT
- Hazard statements
- H317-H315-H319-H334
- Precautionary statements
- P264-P280-P302+P352-P321-P332+P313-P362-P261-P272-P280-P302+P352-P333+P313-P321-P363-P501-P264-P280-P305+P351+P338-P337+P313P-P261-P285-P304+P341-P342+P311-P501
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationPyrazino[2,3-b]pyrazine, decahydro-: INACTIVE
Suppliers11 total
陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]
宁波季诺化学品有限公司0574-87314919 057487319282 · [email protected]
上海仲因实业有限公司2537653158 16621191650 · [email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
武汉凯威斯科技有限公司86-027-67849912 · [email protected]
梯希爱（上海）化工贸易有限公司021-61109150 · [email protected]
Clearsynth Labs Limited+91-22-26355700 · [email protected]
西安莱茵生物科技有限公司86-(0)29-85992781 17792393971 · [email protected]
Novachemistry44-20819178-90 02081917890 · [email protected]
江苏艾康生物医药研发有限公司025-66061636 19370895928 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
Related reactions
2 records
Compound notes
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