6-Nitrobenzo(a)pyren-7-ol acetate (ester)

Modify Date: 2025-10-04 10:21:06

6-Nitrobenzo(a)pyren-7-ol acetate (ester) Structure
6-Nitrobenzo(a)pyren-7-ol acetate (ester) structure
Common Name 6-Nitrobenzo(a)pyren-7-ol acetate (ester)
CAS Number 119087-37-5 Molecular Weight 355.34300
Density 1.447g/cm3 Boiling Point 580.9ºC at 760mmHg
Molecular Formula C22H13NO4 Melting Point N/A
MSDS N/A Flash Point 250.8ºC

 Names

Name (6-nitrobenzo[a]pyren-7-yl) acetate

 Chemical & Physical Properties

Density 1.447g/cm3
Boiling Point 580.9ºC at 760mmHg
Molecular Formula C22H13NO4
Molecular Weight 355.34300
Flash Point 250.8ºC
Exact Mass 355.08400
PSA 72.12000
LogP 6.09390
Vapour Pressure 1.74E-13mmHg at 25°C
Index of Refraction 1.833
InChIKey OLSYDJUQRUQUFT-UHFFFAOYSA-N
SMILES CC(=O)Oc1cccc2c1c([N+](=O)[O-])c1ccc3cccc4ccc2c1c34
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