7-Methylbenzo[a]pyrene - CAS 63041-77-0
Catalog: |
BB031963 |
Product Name: |
7-Methylbenzo[a]pyrene |
CAS: |
63041-77-0 |
Synonyms: |
7-methylbenzo[a]pyrene |
IUPAC Name: | 7-methylbenzo[a]pyrene |
Description: | 7-Methylbenzo[a]pyrene (CAS# 63041-77-0 ) is a useful research chemical. |
Molecular Weight: | 266.34 |
Molecular Formula: | C21H14 |
Canonical SMILES: | CC1=CC=CC2=C1C=C3C=CC4=C5C3=C2C=CC5=CC=C4 |
InChI: | InChI=1S/C21H14/c1-13-4-2-7-17-18-11-10-15-6-3-5-14-8-9-16(12-19(13)17)21(18)20(14)15/h2-12H,1H3 |
InChI Key: | PYVWGNPFWVQISD-UHFFFAOYSA-N |
Melting Point: | 219-220 °C(lit.) |
Purity: | 95 % |
MDL: | MFCD00028971 |
LogP: | 6.04560 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P312, P322, P330, P363, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
WO-2021187056-A1 | Method for producing plate denture, curable stereolithographic composition, and plate denture production kit | 20200317 |
EP-3253583-A1 | Thermal management films containing phase change materials | 20150204 |
EP-3254331-A1 | Systems, structures and materials for electrochemical device thermal management | 20150204 |
JP-2018507773-A | Thermal management film containing phase change material | 20150204 |
JP-2018514052-A | Systems, structures and materials for thermal management of electrochemical devices | 20150204 |
PMID | Publication Date | Title | Journal |
11399192 | 20010618 | Spiral, herringbone, and triple-decker silver(I) complexes of benzopyrene derivatives assembled through eta(2)-coordination | Inorganic chemistry |
Complexity: | 399 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 266.109550447 |
Formal Charge: | 0 |
Heavy Atom Count: | 21 |
Hydrogen Bond Acceptor Count: | 0 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 266.109550447 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 0 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 6.9 |
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