Basic information
- CAS
5660-91-3- Standard SMILES
O=C1C(c2ccccc2)=c2c(c3ccccc3c3ccccc23)=C1c1ccccc1- InChIKey
MNSDGJFEKUKHGO-UHFFFAOYSA-N- Molecular formula
- C29H18O
- Average molar mass
- 382.5 g/mol
- Monoisotopic mass
- 382.13576519
Overview
1,3-diphenylcyclopenta[l]phenanthren-2-one is a cyclic ketone. It derives from a hydride of a cyclopenta[l]phenanthrene.
Names & identifiers
- Preferred name
- 1,3-diphenyl-2H-cyclopenta(l)phenanthren-2-one
- IUPAC
- 1,3-diphenylcyclopenta[l]phenanthren-2-one
- English name
- Phencyclone
- Molecular formula
- C29H18O
- Molecular weight
- 382.45
Names & synonyms
Phencyclone5660-91-31,3-diphenyl-2H-cyclopenta[l]phenanthren-2-one1,3-diphenylcyclopenta[l]phenanthren-2-oneJCN3BF3DH81,3-Diphenyl-2H-cyclopenta(l)phenanthren-2-oneNSC-101867NSC-222805CHEBI:48304DTXSID102051651,3-DIPHENYLCYCLOPENTA(L)PHENANTHREN-2-ONERefChem:72818
Show more names
1,3-di(phenyl)cyclopenta[l]phenanthren-2-one1,3-Diphenyl-2H-cyclopentaphenanthren-2-on2H-Cyclopenta[l]phenanthren-2-one, 1,3-diphenyl-
DTXCID10127656227-112-4MFCD00051451C29H18OEINECS 227-112-4NSC222805UNII-JCN3BF3DH8orb3144385
Database identifiers
- CAS
5660-91-3- PubChem CID
- 97140
- DTXSID
DTXSID10205165- ChEBI
CHEBI:48304- UNII
- JCN3BF3DH8
- EC Number
- 227-112-4
Properties
Computed structural properties
- XLogP
- 6.1
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 680
Physicochemical properties
- Melting point
- 245 · 245-249°C
- BRN
- 2061817 · 2061817
- FDA UNII
- 3 BF3DH8 · JCN3BF3DH8
- Safety Statements
- 22 · 22-24/25
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
- safety_code
- 22-24/25
Chemistry & industry
Suppliers26 total
郑州汇聚化工有限公司13393710386 · [email protected]
陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]
阿法埃莎（中国）化学有限公司400-6106006 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
吉林中科研伸科技有限公司18143011203 · [email protected]
河南欧博尔光电科技有限公司0371-65322607 18860389453 · [email protected]
TargetMol 中国（陶术生物）400-821-0310 15002144251 · [email protected]
上海昶衍化工科技有限公司021-20242659 18930833303 · [email protected]
南京恰风和医药科技有限公司025-57018978 18251899859 · [email protected]
河南东元化工科技有限公司16696119288 · [email protected]
Alfa Chemistry1-516-6625404 · [email protected]
Alfa Chemistry+1-5166625404 · [email protected]
上海启乔生物科技有限公司021-37653318 15221675714 · [email protected]
河南普赛化工产品有限公司0371-60919097 15378766539 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…