1,3,5-Triazine-2,4-diamine, 6,6'-(1,4-butanediyl)bis-
Basic information
- CAS
4341-27-9- Standard SMILES
Nc1nc(N)nc(CCCCc2nc(N)nc(N)n2)n1- InChIKey
VVYBFJSLGGZKFD-UHFFFAOYSA-N- Molecular formula
- C10H16N10
- Average molar mass
- 276.3 g/mol
- Monoisotopic mass
- 276.15594055
Names & identifiers
- Preferred name
- 1,3,5-Triazine-2,4-diamine, 6,6'-(1,4-butanediyl)bis-
- IUPAC
- 6-[4-(4,6-diamino-1,3,5-triazin-2-yl)butyl]-1,3,5-triazine-2,4-diamine
- English name
- 6,6'-(butane-1,4-diyl)bis(1,3,5-triazine-2,4-diamine)
- Molecular formula
- C10H16N10
- Molecular weight
- 276.30104
Names & synonyms
1,3,5-Triazine-2,4-diamine, 6,6'-(1,4-butanediyl)bis-EINECS 224-394-0NSC 101825DTXSID7063421RefChem:412603DTXCID9040265Adipoguanamine4341-27-9NSC1018256,6'-(Butane-1,4-diyl)bis(1,3,5-triazine-2,4-diamine)NSC-1018256-[4-(4,6-diamino-1,3,5-triazin-2-yl)butyl]-1,3,5-triazine-2,4-diamine
Show more names
1,4-Bis(2,4-diamino-1,3,5-triazin-6-yl)butane6,6'-(1,4-Butanediyl)bis(1,3,5-triazine-2,4-diamine)
NCIStruc1_000681NCIStruc2_000664SCHEMBL1707515CHEMBL1985719VVYBFJSLGGZKFD-UHFFFAOYSA-NCCG-36295NCGC00014060AKOS024381481
Database identifiers
- CAS
4341-27-9- PubChem CID
- 78042
- DTXSID
DTXSID7063421- ChEMBL
CHEMBL1985719- EC Number
- 224-394-0
- Nikkaji
- J52.296A
Properties
Computed structural properties
- XLogP
- -0.4
- Topological polar surface area
- 181 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 5
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 241
Physicochemical properties
- EPA Substance Registry System
- 1 · 1,3,5-Triazine-2,4-diamine, 6,6'-(1,4-butanediyl)bis- (4341-27-9)
- TSCA
- TSCA listed
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
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing Information1,3,5-Triazine-2,4-diamine, 6,6'-(1,4-butanediyl)bis-: INACTIVE
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Related reactions
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Compound notes
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