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CAS Number: 40353-34-2
7-nitro-3,4-dihydronaphthalen-1(2H)-one

Structure

 7-nitro-3,4-dihydronaphthalen-1(2H)-one
Name: 7-nitro-3,4-dihydronaphthalen-1(2H)-one
Synonyms:
General Information
Product Number: 40353342

CAS Registry Number 40353-34-2
Name:
1(2H)?-?Naphthalenone, 3,?4-?dihydro-?7-?nitro-
3,4-Dihydro-7-nitronaphthalen-1(2H)-one
7-Nitro-1-tetralone
7-Nitro-3,4-dihydro-1(2H)-naphthalenone
7-Nitro-3,4-dihydro-2H-naphthalen-1-one
7-Nitro-α-tetralone

 

Chemical Formula: C10H9NO3
Exact Mass: 191.06
Molecular Weight: 191.18
m/z: 191.06 (100.0%), 192.06 (11.4%), 193.06 (1.2%)

 

InChI:InChI=1S/C10H9NO3/c12-10-3-1-2-7-4-5-8(11(13)14)6-9(7)10/h4-6H,1-3H2

InChI Key:GWAQYWSNCVEJMW-UHFFFAOYSA-N

Canonical SMILES:C1CC2=C(C=C(C=C2)[N+](=O)[O-])C(=O)C1

 

Thermal Properties Value Condition Note
Melting Point 107 °C   (5)IC
Melting Point 106-108 °C Solv: hexane (110-54-3) (3)IC
Melting Point 105-106 °C   (6)CAS
Melting Point 103.5-103.6 °C   (1)CAS

Specification

98%
References
  1. (1) Silva, Luiz F., Jr.; Journal of the Brazilian Chemical Society 2005, V16(6A), P1160-1173 CAPLUS
  2. (3) Nichols, David E.; Journal of Medicinal Chemistry 1989, V32(9), P2128-34 CAPLUS
  3. (5) Bardakos, Vasilios; Chemische Berichte 1978, V111(5), P1780-8 CAPLUS
  4. (6) Nakamura, Katsutaro; Yakugaku Zasshi 1942, V62, P236-9 CAPLUS
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