Methylenephenanthrene

HCID 9147CAS 203-64-5

基本情報

標準SMILES: c1cc2c3c(c1)ccc1cccc(c13)C2
InChIKey: RKZDZWJDQTZDLD-UHFFFAOYSA-N
分子式: C15H10
平均分子量: 190.24 g/mol
単同位体質量: 190.07825032

名称と識別子

優先名称: Methylenephenanthrene
IUPAC: tetracyclo[10.2.1.05,14.08,13]pentadeca-1,3,5(14),6,8(13),9,11-heptaene
英語名: 4,5-Methylenephenanthrene
分子式: C15H10
分子量: 190.24

名称と別名

203-64-54H-Cyclopenta[def]phenanthreneMethylenephenanthrene4,5-METHYLENEPHENANTHRENE4H-Cyclopenta(def)phenanthrene4,5-PhenanthrylenemethaneBenzo(def)fluoreneBenzo[def]fluoreneMethane, 4,5-phenanthrylene-Phenanthrene, 4,5-methylene-NSC 88888CCRIS 5797

名称をさらに表示

DTXSID10248874-H-Cyclopenta(d,e,f)phenanthreneEINECS 205-905-6UNII-U16R456Q1YBRN 2043908AI3-52512U16R456Q1YNSC-88888

データベース識別子

CAS: 203-64-5
PubChem CID: 9147
DTXSID: DTXSID1024887
ChEMBL: CHEMBL1491899
UNII: U16R456Q1Y
EC Number: 205-905-6
Nikkaji: J34.897J

物性

構造計算による物性

XLogP: 4.4
極性表面積: 0 Å²
水素結合供与体数: 0
水素結合受容体数: 0
回転可能結合数: 0
重原子数: 15
形式電荷: 0
複雑度: 231

実験および物理化学的性質

Kovats Retention Index · 2 件

1879；1887；1888；322.1；322.3

1864.28；1876.18；1875；1936；318.6；322.18；325.73；321.96；322.08；322.18；325.73；318.6；322.08；322.3；319.1；322.64；319.5；321.96；322.3；322.42

物理化学的性質

融点: 114 °C · 114 °C
沸点: 353 °C · 353 °C
比重(密度): 1.257 · 1.257±0.06 g/cm3(Predicted)

安全と法規制

GHS分類

GHS Classification · 3 件

This chemical does not meet GHS hazard criteria for 100% (3 of 3) of all reports.

Not Classified；Reported as not meeting GHS hazard criteria by 3 of 3 companies. For more detailed information, please visit ECHA C&L website.

Aggregated GHS information provided per 3 reports by companies from 1 notifications to the ECHA C&L Inventory.；Reported as not meeting GHS hazard criteria per 3 of 3 reports by companies.；There are 0 notifications provided by 0 of 3 reports by companies with hazard statement code(s).；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.