Basic information
- CAS
6456-93-5- Standard SMILES
Cc1ccc(=O)n(C)c1- InChIKey
HQPIILKGTFWSDJ-UHFFFAOYSA-N- Molecular formula
- C7H9NO
- Average molar mass
- 123.15 g/mol
- Monoisotopic mass
- 123.06841391
Names & identifiers
- Preferred name
- 2(1H)-Pyridone, 1,5-dimethyl-
- IUPAC
- 1,5-dimethylpyridin-2-one
- English name
- 1,5-Dimethyl-2(1H)-pyridone
- Molecular formula
- C7H9NO
- Molecular weight
- 123.15
Names & synonyms
6456-93-51,5-dimethylpyridin-2(1H)-one2(1H)-Pyridone, 1,5-dimethyl-1,5-Dimethyl-2(1H)-pyridone1,5-Dimethyl-2-pyridinone1,5-dimethyl-1,2-dihydropyridin-2-one1,5-dimethylpyridin-2-one2(1H)-Pyridinone, 1,5-dimethyl-1,5-Dimethyl-2-pyridoneSCHEMBL12063SCHEMBL2308516SCHEMBL3586902
Show more names
HQPIILKGTFWSDJ-UHFFFAOYSA-NDTXSID6013122801,5-Dimethyl-2(1H)-pyridinone #MFCD25965743AKOS016551901SY373000
Database identifiers
- CAS
6456-93-5- PubChem CID
- 565112
- DTXSID
DTXSID601312280- Nikkaji
- J101.111A
Properties
Computed structural properties
- XLogP
- 0.3
- Topological polar surface area
- 20.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 191
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers5 total
安徽合诺生物科技有限公司0555-2761852
上海创焰化学科技有限公司021-11111111 11111111111 · [email protected]
南京麦瑞米生物技术有限公司025-87782433 18021532344 · [email protected]
上海兰科化学有限公司021-61916491 15921747686 · [email protected]
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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