3-nitrobenzo(a)pyrene-7,8-diol-9,10-epoxide

Modify Date: 2025-08-27 06:25:47

3-nitrobenzo(a)pyrene-7,8-diol-9,10-epoxide Structure
3-nitrobenzo(a)pyrene-7,8-diol-9,10-epoxide structure
Common Name 3-nitrobenzo(a)pyrene-7,8-diol-9,10-epoxide
CAS Number 149559-16-0 Molecular Weight 347.32100
Density 1.699g/cm3 Boiling Point 658.3ºC at 760 mmHg
Molecular Formula C20H13NO5 Melting Point N/A
MSDS N/A Flash Point 351.9ºC

 Names

Name ccris 8055

 Chemical & Physical Properties

Density 1.699g/cm3
Boiling Point 658.3ºC at 760 mmHg
Molecular Formula C20H13NO5
Molecular Weight 347.32100
Flash Point 351.9ºC
Exact Mass 347.07900
PSA 98.81000
LogP 3.86320
Vapour Pressure 3.15E-18mmHg at 25°C
Index of Refraction 1.948
InChIKey IRRRBEKHSFTNCO-WCIQWLHISA-N
SMILES O=[N+]([O-])c1ccc2ccc3c4c(cc5ccc1c2c53)C(O)C(O)C1OC41
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