1-(Bromoacetyl)pyrene - CAS 80480-15-5
Catalog: |
BB036509 |
Product Name: |
1-(Bromoacetyl)pyrene |
CAS: |
80480-15-5 |
Synonyms: |
2-bromo-1-pyren-1-ylethanone |
IUPAC Name: | 2-bromo-1-pyren-1-ylethanone |
Description: | 1-(Bromoacetyl)pyrene (CAS# 80480-15-5) is a novel photoinitiator. |
Molecular Weight: | 323.18 |
Molecular Formula: | C18H11BrO |
Canonical SMILES: | C1=CC2=C3C(=C1)C=CC4=C(C=CC(=C43)C=C2)C(=O)CBr |
InChI: | InChI=1S/C18H11BrO/c19-10-16(20)14-8-6-13-5-4-11-2-1-3-12-7-9-15(14)18(13)17(11)12/h1-9H,10H2 |
InChI Key: | KAEDEGFCOPIKKM-UHFFFAOYSA-N |
Boiling Point: | 476.7 °C at 760 mmHg |
Density: | 1.563 g/cm3 |
MDL: | MFCD00191839 |
LogP: | 5.16160 |
GHS Hazard Statement: | H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation] |
Precautionary Statement: | P260, P264, P273, P280, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P321, P363, P405, and P501 |
Signal Word: | Danger |
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PMID | Publication Date | Title | Journal |
19610356 | 20090501 | Determination of dialkyl phosphates as breakdown products of organophosphorus insecticides in fruit juices by HPTLC with fluorescence detection | Journal of AOAC International |
19046982 | 20090201 | Detection of okadaic acid and related esters in mussels during diarrhetic shellfish poisoning (DSP) episodes in Greece using the mouse bioassay, the PP2A inhibition assay and HPLC with fluorimetric detection | Toxicon : official journal of the International Society on Toxinology |
Complexity: | 393 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 321.99933 |
Formal Charge: | 0 |
Heavy Atom Count: | 20 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 321.99933 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 17.1 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 5.5 |
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