2-Amino-4,6-dimethylpyrimidin-5-ol
Basic information
- CAS
685897-68-1- Standard SMILES
Cc1nc(N)nc(C)c1O- InChIKey
BATVWQIPSVQPEI-UHFFFAOYSA-N- Molecular formula
- C6H9N3O
- Average molar mass
- 139.16 g/mol
- Monoisotopic mass
- 139.07456192
Names & identifiers
- Preferred name
- 2-Amino-4,6-dimethylpyrimidin-5-ol
- IUPAC
- 2-amino-4,6-dimethylpyrimidin-5-ol
- English name
- 5-Pyrimidinol, 2-amino-4,6-dimethyl- (9CI)
- Molecular formula
- C6H9N3O
- Molecular weight
- 139.16
Names & synonyms
685897-68-12-AMINO-4,6-DIMETHYLPYRIMIDIN-5-OLRefChem:464021825-127-62-amino-4,6-dimethyl-5-pyrimidinol5-Pyrimidinol, 2-amino-4,6-dimethyl- (9CI)SCHEMBL2842749KCB89768MFCD155275202-amino-4,6-dimethyl-pyrimidin-5-olAKOS006339629AT18377
Show more names
5-PyriMidinol, 2-aMino-4,6-diMethyl-
2-Amino-5-hydroxy-4,6-dimethyl-pyrimidinEN300-1726422Z1203580754
Database identifiers
- CAS
685897-68-1- PubChem CID
- 19922980
- EC Number
- 825-127-6
Properties
Computed structural properties
- XLogP
- 0.3
- Topological polar surface area
- 72 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 0
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 108
Physicochemical properties
- Melting point
- 208 °C · 208 °C (decomp)
- Boiling point
- 361.1 · 361.1±34.0 °C(Predicted)
- Density
- 1.275 · 1.275±0.06 g/cm3(Predicted)
- pka
- 4.66 · 4.66±0.33(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 319 · H319-H302-H315-H335
- Precautionary statements
- 264 · P264-P270-P301+P312-P330-P501-P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362
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
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 2 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
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H319-H302-H315-H335
- Precautionary statements
- P264-P270-P301+P312-P330-P501-P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…