CAS 602-60-8 9-nitroanthracene - Materials / Alfa Chemistry

NAVIGATION

9-nitroanthracene

PRICE INQUIRY

Catalog Number

ACM602608-1

CAS Number

602-60-8

Product Name

9-nitroanthracene

Structure

Category

Small Molecule Semiconductor Building Blocks; Semiconductor Blocks

Synonyms

5-Nitroanthracene

Description

9-nitroanthracene is a yellow solid. (NTP, 1992)

IUPAC Name

9-nitroanthracene

Molecular Weight

223.23

Molecular Formula

C14H9NO2

Canonical SMILES

C1=CC=C2C(=C1)C=C3C=CC=CC3=C2[N+](=O)[O-]

InChI

InChI=1S/C14H9NO2/c16-15(17)14-12-7-3-1-5-10(12)9-11-6-2-4-8-13(11)14/h1-9H

InChI Key

LSIKFJXEYJIZNB-UHFFFAOYSA-N

Boiling Point

275 ºC 17mmHg

Melting Point

141-144 ºC

Purity

99%+

Density

1.1814 g/ml

Solubility

less than 0.1 mg/mL at 64° F (NTP, 1992);5.11e-07 M

Application

9-nitroanthracene serves as a critical precursor for the synthesis of anthraquinones, compounds frequently utilized as photosensitizers in photodynamic therapy (PDT) for cancer treatment. These anthraquinones are essential in the development of therapeutic drugs, including Emodin, Aloe-emodin, and Rufgallol. As a member of the anthracene family, 9-nitroanthracene holds significant promise in advancing cancer therapies due to its foundational role in creating these important medical agents.

Complexity

277

Covalently-Bonded Unit Count

EC Number

210-021-9

Exact Mass

223.063329g/mol

Formal Charge

Heavy Atom Count

Log P

4.78 (LogP)

MeSH Entry Terms