Basic information
- CAS
119754-17-5- Standard SMILES
C#Cc1ccc(C(=O)c2ccccc2)cc1- InChIKey
GMJRQKHAIVLPIR-UHFFFAOYSA-N- Molecular formula
- C15H10O
- Average molar mass
- 206.24 g/mol
- Monoisotopic mass
- 206.07316494
Names & identifiers
- Preferred name
- 4-Benzoylphenylethyne
- IUPAC
- (4-ethynylphenyl)-phenylmethanone
- English name
- (4-Ethynylphenyl)phenyl-methanone
- Molecular formula
- C15H10O
- Molecular weight
- 206.24
Names & synonyms
119754-17-54-benzoylphenylethyneDTXSID50478194RefChem:290286DTXCID90429004(4-ethynylphenyl)phenyl-methanoneMethanone, (4-ethynylphenyl)phenyl-(4-Ethynylphenyl)phenylmethanone(4-ETHYNYLPHENYL)(PHENYL)METHANONEMFCD00448038p-ethynylbenzophenoneSCHEMBL739782
Show more names
GMJRQKHAIVLPIR-UHFFFAOYSA-N(4-ethynylphenyl)-phenyl-methanoneAB87778DB-200306G80570
Database identifiers
- CAS
119754-17-5- PubChem CID
- 12132004
- DTXSID
DTXSID50478194- Nikkaji
- J652.815E
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 282
Physicochemical properties
- storage temp.
- Store at Room Tem.
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 303 · H303-H320
- Precautionary statements
- 312 · P312-P264-P305+P351+P338-P337+P313
Safety & regulation
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H303-H320
- Precautionary statements
- P312-P264-P305+P351+P338-P337+P313
Chemistry & industry
Suppliers3 total
苏州爱玛特生物科技有限公司0512-56316828 400-867-5858;400-867-5858 · [email protected]
河南威梯希化工科技有限公司0371-53732842 13383863444 · [email protected]
Nextpeptide Inc+86-0571-81612335 +8613336028439 · [email protected]
Related reactions
3 records
Compound notes
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