Basic information
- CAS
17386-89-9- Standard SMILES
CCCC(=O)c1ccc(O)c(O)c1- InChIKey
NLERVTXJOGYIKC-UHFFFAOYSA-N- Molecular formula
- C10H12O3
- Average molar mass
- 180.2 g/mol
- Monoisotopic mass
- 180.07864424
Names & identifiers
- Preferred name
- 1-(3,4-Dihydroxyphenyl)-1-butanone
- IUPAC
- 1-(3,4-dihydroxyphenyl)butan-1-one
- English name
- 1-(3,4-Dihydroxyphenyl)butan-1-one
- Molecular formula
- C10H12O3
- Molecular weight
- 180.2
Names & synonyms
17386-89-91-Butanone, 1-(3,4-dihydroxyphenyl)-1-(3,4-Dihydroxyphenyl)-1-butanoneDTXSID70169673RefChem:1054089DTXCID00921641-(3,4-dihydroxyphenyl)butan-1-one4-Butyroylpyrocatechol3',4'-Dihydroxy-1-phenyl-2-butanone3',4'-DihydroxybutyrophenoneMFCD01737515BRN 2255748
Show more names
3’,4’-Dihydroxy-1-phenyl-2-butanone
BUTYROPHENONE, 3',4'-DIHYDROXY-1-Butanone, 1-(3,4-dihydroxyphenyl)- (9CI)4-08-00-01864 (Beilstein Handbook Reference)SCHEMBL56815823,4-Dihydroxy-1-phenyl-2-butanoneAKOS022640516NS-01564DB-225595
Database identifiers
- CAS
17386-89-9- PubChem CID
- 28512
- DTXSID
DTXSID70169673- Nikkaji
- J42.935J
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 57.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 179
Physicochemical properties
- solubility
- Dichloromethane, Ethyl Acetate, Methanol
- form
- Solid
- color
- Grey
Chemistry & industry
Applications
Uses3’,4’-Dihydroxy-1-phenyl-2-butanone (cas# 17386-89-9) is a compound useful in organic synthesis.
Upstream & downstream products
Upstream raw materials
Downstream products
Suppliers8 total
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
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安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
艾吉析科技（上海）有限公司17717235263 17717235263 · [email protected]
上海林栎生物科技有限公司13761635123 · [email protected]
深圳聚合生化科技有限公司+86-400-002-6226 13028896684 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
合肥钼凯医药科技有限公司18001872185; 18001872185 · [email protected]
Related reactions
0 records
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Compound notes
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