Basic information
- CAS
32511-84-5- Standard SMILES
CCCCn1c(=O)cc(C)c2ccccc21- InChIKey
BDQRFECVDXBVMM-UHFFFAOYSA-N- Molecular formula
- C14H17NO
- Average molar mass
- 215.29 g/mol
- Monoisotopic mass
- 215.13101417
Names & identifiers
- Preferred name
- 1-Butyl-4-methylquinolin-2(1h)-one
- IUPAC
- 1-butyl-4-methylquinolin-2-one
- English name
- 1-butyl-4-methyl-2(1H)quinoline
- Molecular formula
- C14H17NO
- Molecular weight
- 215.29
Names & synonyms
1-butyl-4-methylquinolin-2(1h)-one32511-84-51-butyl-4-methylquinolin-2-one1-butyl-4-methyl-2(1H)-Quinolinone1-Butyl-4-Methyl-2(1H)Quinoline1-butyl-4-methyl-1,2-dihydroquinolin-2-one1-BUTYL-4-METHYL-2(1H)QUINOLINONEMFCD11079287NSC109799SCHEMBL10381468DTXSID302965351-butyl-4-methyl-quinolin-2-one
Show more names
4-BroMoMethyl-11-Butyl-4-methylcarbostyril2(1H)-Quinolinone,1-butyl-4-Methyl-
RB3073AKOS003059265NSC-109799SB69234AC-25828AS-60650DB-068644CS-0061499
Database identifiers
- CAS
32511-84-5- PubChem CID
- 269196
- DTXSID
DTXSID30296535- Nikkaji
- J639.107I
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 20.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 295
Physicochemical properties
- Boiling point
- 311 ℃ · 311℃
- Density
- 1.046 · 1.046
- Flash point
- 133 ℃ · 133℃
- storage temp.
- 2 · 2-8°C
- pka
- 0.52 · 0.52±0.40(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P305+P351+P338
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
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
Chemistry & industry
Suppliers18 total
爱斯特（成都）生物制药股份有限公司+86-28-85122536 85324413 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
Shanghai Witofly Chemical Co.,Ltd[email protected]
PT CHEM GROUP LIMITED+86-85511178; +86-85511178 · [email protected]
开封明仁药业有限公司0371-65741762 · [email protected]
上海阿拉丁生化科技股份有限公司6206333 13167063860 · [email protected]
上海睿升化工科技有限公司15026594951 · [email protected]
杭州洁汉化工有限公司+86-571-86217390; +8618058761490 · [email protected]
Capot Chemical Co.,Ltd.+86-（0）57185586718 +86-13336195806 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 19370895928 · [email protected]
career henan chemical co+86-0371-86658258 · [email protected]
Zjartspharm Co., Ltd15068876005 · [email protected]
上海凯为化学科技有限公司
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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