6-(1-Methylethoxy)-1,3,5-triazine-2,4-diamine
Basic information
- CAS
24860-40-0- Standard SMILES
CC(C)Oc1nc(N)nc(N)n1- InChIKey
ATCQNYLEZRQALQ-UHFFFAOYSA-N- Molecular formula
- C6H11N5O
- Average molar mass
- 169.19 g/mol
- Monoisotopic mass
- 169.09635999
Names & identifiers
- Preferred name
- 6-(1-Methylethoxy)-1,3,5-triazine-2,4-diamine
- IUPAC
- 6-propan-2-yloxy-1,3,5-triazine-2,4-diamine
- English name
- 2,4-Diamino-6-isopropoxy-1,3,5-triazine
- Molecular formula
- C6H11N5O
- Molecular weight
- 169.18
Names & synonyms
24860-40-0s-Triazine, 4,6-diamino-2-isopropoxy-DTXSID40179567RefChem:10736626-(1-Methylethoxy)-1,3,5-triazine-2,4-diamineDTXCID001020582,4-Diamino-6-isopropoxy-1,3,5-triazine6-Isopropoxy-1,3,5-triazine-2,4-diamine1,3,5-Triazine-2,4-diamine, 6-(1-methylethoxy)-6-propan-2-yloxy-1,3,5-triazine-2,4-diamineMFCD00191339BRN 0150110
Show more names
Diaminoisopropoxytriazine4,6-diamino-2-isopropoxy-s-triazin6-Isopropoxy-s-triazine-2,4-diamine5-triazine-2,4-diamine,6-(1-methylethoxy)-32,4-DIAMINO-6-ISOPROPOXY-1,3,5-TRIAZINE 98+%
4,6-Diamino-2-isopropoxy-s-triazineAI3-60402SCHEMBL139950ATCQNYLEZRQALQ-UHFFFAOYSA-NAKOS015855029SB73457AS-86475CS-0328233
Database identifiers
- CAS
24860-40-0- PubChem CID
- 32722
- DTXSID
DTXSID40179567- Nikkaji
- J48.132G
Properties
Computed structural properties
- XLogP
- 0.4
- Topological polar surface area
- 99.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 2
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 132
Physicochemical properties
- Melting point
- 172 °C · 172 °C
- Boiling point
- 401.1 · 401.1±28.0 °C(Predicted)
- Density
- 1.29 · 1.290±0.06 g/cm3(Predicted)
- pka
- 4.9 · 4.90±0.10(Predicted)
- form
- powder to crystal
- color
- White to Almost white
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319
- Precautionary statements
- 264 · P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313
- RTECS
- 6880000 · XY6880000
- HS Code
- 2933.69 · 2933.69.6050
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
- rtecs
- XY6880000
- hs_code
- 2933.69.6050
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H315-H319
- Precautionary statements
- P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313
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Compound notes
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