Basic information
- Standard SMILES
Cc1cc(C(=C2C=CC(=O)C=C2)c2ccc(O)cc2)ccc1O- InChIKey
TWNIXJJSBDRPSN-UHFFFAOYSA-N- Molecular formula
- C20H16O3
- Average molar mass
- 304.3 g/mol
- Monoisotopic mass
- 304.10994437
Names & identifiers
- Preferred name
- 4-((4-Hydroxy-3-methylphenyl)(4-hydroxyphenyl)methylene)cyclohexa-2,5-dien-1-one
- IUPAC
- 4-[(4-hydroxy-3-methylphenyl)-(4-hydroxyphenyl)methylidene]cyclohexa-2,5-dien-1-one
- English name
- 4-[(4-hydroxy-3-methylphenyl)(4-hydroxyphenyl)methylene]cyclohexa-2,5-dien-1-one
- Molecular formula
- C20H16O3
- Molecular weight
- 304.33924
Names & synonyms
4-((4-Hydroxy-3-methylphenyl)(4-hydroxyphenyl)methylene)cyclohexa-2,5-dien-1-one35675-66-2EINECS 252-671-64-[(4-hydroxy-3-methylphenyl)(4-hydroxyphenyl)methylene]cyclohexa-2,5-dien-1-oneDTXSID001891822,5-Cyclohexadien-1-one, 4-[(4-hydroxy-3-methylphenyl)(4-hydroxyphenyl)methylene]-2,5-Cyclohexadien-1-one, 4-((4-hydroxy-3-methylphenyl)(4-hydroxyphenyl)methylene)-RefChem:509497DTXCID30111673252-671-6633-00-14-(Bis(4-hydroxyphenyl)methylene)-2-methyl-2,5-cyclohexadien-1-one
Show more names
2,5-Cyclohexadien-1-one, 4-(4-hydroxy-3-methylphenyl)(4-hydroxyphenyl)methylene-4-[(4-Hydroxy-3-methylphenyl)(4-hydroxyphenyl)methylene]-2,5-cyclohexadien-1-one
4-[(4-hydroxy-3-methylphenyl)-(4-hydroxyphenyl)methylidene]cyclohexa-2,5-dien-1-oneBRN 25922322,5-Cyclohexadien-1-one, 4-(bis(p-hydroxyphenyl)methylene)-2-methyl-4-(Bis(p-hydroxyphenyl)methylene)-2-methyl-2,5-cyclohexadien-1-oneSCHEMBL28938042TWNIXJJSBDRPSN-UHFFFAOYSA-NWSRGFVKIQYLNMY-UHFFFAOYSA-NDTXSID201317969
Database identifiers
- CAS
35675-66-2、633-00-1- PubChem CID
- 120307
- DTXSID
DTXSID00189182- EC Number
- 252-671-6
- Nikkaji
- J135.617H、J260.668B
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 57.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 517
Experimental & physicochemical properties
Endocrine DisruptorsPotential endocrine disrupting compound
Safety & regulation
Hazard information
Regulatory Information4-((4-Hydroxy-3-methylphenyl)(4-hydroxyphenyl)methylene)cyclohexa-2,5-dien-1-one: Does not have an individual approval but may be used under an appropriate group standard
Chemistry & industry
Suppliers16 total
湖北万得化工有限公司15377098680 15377098680 · [email protected]
Hebei Chuanghai Biotechnology Co., Ltd+86-17732866630 · [email protected]
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
上海如吉生物科技发展有限公司+86-21-65211385-8001 36031160 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
广东大小化工有限公司1866-171603 18666171603 · [email protected]
玛雅试剂+86 (573) 82222445 (0)18006601000 452520369 · [email protected]
斯百全化学（上海）有限公司021-021-021-67601398-809-809-809 15221380277 · [email protected]
成都零六生物科技有限公司400-1166-196 13458535857 · [email protected]
Alfa Chemistry+1-5166625404 · [email protected]
湖北齐飞医药化工有限公司027-59322506 18071128681 · [email protected]
杭州洁汉化工有限公司+86-571-86217390; +8618058761490 · [email protected]
XIAMEN AMITY INDUSTRY AND TRADE CO., LTD.+8618950047208 · [email protected]
SUZHOU SENFEIDA CHEMICAL CO.,LTD+86-0512-83500002 +86-15195660023 · [email protected]
重庆卡兰医药有限公司[email protected]
Hefei TNJ Chemical Industry Co.,Ltd.+86-0551-65418671 +86-189 4982 3763 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Linked notes
Loading…