Basic information
- CAS
55477-35-5- Standard SMILES
Cc1c(O)nc(N)[nH]c1=O- InChIKey
OTFOORSARCXWKK-UHFFFAOYSA-N- Molecular formula
- C5H7N3O2
- Average molar mass
- 141.13 g/mol
- Monoisotopic mass
- 141.05382648
Names & identifiers
- Preferred name
- 2-Amino-6-hydroxy-5-methyl-1H-pyrimidin-4-one
- IUPAC
- 2-amino-4-hydroxy-5-methyl-1H-pyrimidin-6-one
- English name
- 2-amino-6-hydroxy-5-methyl-1H-pyrimidin-4-one
- Molecular formula
- C5H7N3O2
- Molecular weight
- 141.13
Names & synonyms
2-Amino-6-hydroxy-5-methyl-1H-pyrimidin-4-oneEINECS 229-597-8NSC 60209RefChem:464775229-597-82-Amino-4,6-dihydroxy-5-methylpyrimidine6627-65-22-amino-5-methylpyrimidine-4,6-diol2-Amino-6-hydroxy-5-methylpyrimidin-4(3H)-one2-amino-4-hydroxy-5-methyl-1H-pyrimidin-6-oneMFCD000232576-Hydroxy-2-imino-5-methyl-2,3-dihydropyrimidin-4(1h)-one
Show more names
2-Amino-6-hydroxy-5-methylpyrimidin-4(1H)-one4(3H)-Pyrimidinone, 2-amino-6-hydroxy-5-methyl-4(1H)-Pyrimidinone, 2-amino-6-hydroxy-5-methyl- (9CI)
4(1H)-Pyrimidinone,2-amino-6-hydroxy-5-(1-methylethyl)-(9CI)NSC60209EINECS 259-660-5Oprea1_306579SCHEMBL2488690HMS1611G03NSC-60209SBB005534
Database identifiers
- CAS
55477-35-5、6627-65-2- PubChem CID
- 81111
- DTXSID
DTXSID30970823- EC Number
- 229-597-8
Properties
Computed structural properties
- XLogP
- -1.1
- Topological polar surface area
- 87.7 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 241
Physicochemical properties
- Density
- 1.67 · 1.67±0.1 g/cm3(Predicted)
- pka
- 7.92 · 7.92±0.10(Predicted)
- Symbol(GHS)
- 7 · GHS07,GHS05
- Signal word
- Danger
- Hazard statements
- 317 · H317-H315-H318-H335
- Precautionary statements
- 261 · P261-P272-P280-P302+P352-P333+P313-P321-P363-P501-P280-P305+P351+P338-P310-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
Danger
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P272, P280, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P332+P317, P333+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 38 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 CategoriesSkin Irrit. 2 (100%)
Safety data
- Signal word
- Danger
- Symbol(GHS)
- GHS07,GHS05
- Hazard statements
- H317-H315-H318-H335
- Precautionary statements
- P261-P272-P280-P302+P352-P333+P313-P321-P363-P501-P280-P305+P351+P338-P310-P264-P280-P302+P352-P321-P332+P313-P362
Chemistry & industry
Upstream & downstream products
Downstream products
Suppliers5 total
苏州市森菲达化工有限公司18796480002 18796480002 · [email protected]
环生美森医药技术（山东）有限公司0531-88762217 18301471076 · [email protected]
天成化工(江苏)有限公司0512-66387919 18662433356 · [email protected]
重庆卡兰医药有限公司[email protected]
陕西缔都化学有限公司17691182729 17392216275 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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