Basic information
- CAS
42310-45-2- Standard SMILES
Nc1ncc(CO)c(N)n1- InChIKey
MMDZZHAZMNJFMW-UHFFFAOYSA-N- Molecular formula
- C5H8N4O
- Average molar mass
- 140.14 g/mol
- Monoisotopic mass
- 140.06981088
Names & identifiers
- Preferred name
- 2,4-Diamino-5-pyrimidinemethanol
- IUPAC
- (2,4-diaminopyrimidin-5-yl)methanol
- English name
- 2,4-Diamino-5-pyrimidinemethanol
- Molecular formula
- C5H8N4O
- Molecular weight
- 140.14
Names & synonyms
2,4-Diamino-5-pyrimidinemethanol42310-45-2(2,4-diaminopyrimidin-5-yl)methanol2,4-Diamino-5-pyrimidinemethanoMFCD06410821NSC165500SCHEMBL7560692DTXSID40304352MMDZZHAZMNJFMW-UHFFFAOYSA-N2,4-Diamino-5-hydroxymethylpyrimidineAKOS006295608AB24931
Show more names
5-Pyrimidinemethanol, 2,4-diamino-5-Pyrimidinemethanol, 2,4-diamino- (6CI,9CI)2,4-Diamino-5-pyrimidinemethanol ISO 9001：2015 REACH
NSC-1655002,4-diamino-5-(hydroxymethyl)pyrimidineAC-26609DB-019866CS-0045836EN300-396107
Database identifiers
- CAS
42310-45-2- PubChem CID
- 295878
- DTXSID
DTXSID40304352- EC Number
- 884-188-7
- Nikkaji
- J2.846.438J
Properties
Computed structural properties
- XLogP
- -0.8
- Topological polar surface area
- 98.1 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 1
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 110
Physicochemical properties
- Melting point
- 265 °C · 265 °C (decomp)
- Boiling point
- 502 · 502.0±58.0 °C(Predicted)
- Density
- 1.486 · 1.486±0.06 g/cm3(Predicted)
- pka
- 13.22 · 13.22±0.10(Predicted)
Chemistry & industry
Applications
Uses2,4-Diamino-5-pyrimidinemethano can be useful in the preparation of diaminopyrimidines as inhibitors of dihydrofolate reductase of opportunistic pathogens.
Upstream & downstream products
Upstream raw materials
Suppliers21 total
陕西缔都新材料有限公司81124267 17392282731 · [email protected]
上海策嵘生物科技有限公司[email protected]
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
KARMEL TECHNOLOGY (HK) CO.,LIMITED
Related reactions
21 records
Compound notes
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