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CAS Number: 102121-55-1
1,1,4,4-tetramethyl-6-nitro-1,2,3,4-tetrahydronaphthalene

Structure

 1,1,4,4-tetramethyl-6-nitro-1,2,3,4-tetrahydronaphthalene
Name: 1,1,4,4-tetramethyl-6-nitro-1,2,3,4-tetrahydronaphthalene
Synonyms:
General Information
Product Number: 102121551

CAS Registry Number 102121-55-1
Name:
Naphthalene, 1,?2,?3,?4-?tetrahydro-?1,?1,?4,?4-?tetramethyl-?6-?nitro-
1,1,4,4-Tetramethyl-6-nitro-1,2,3,4-tetrahydronaphthalene
2-Nitro-5,5,8,8-tetramethyl-5,6,7,8-tetrahydronaphthalene
2-Nitro-5,6,7,8-tetrahydro-5,5,8,8-tetramethylnaphthalene

 

Chemical Formula: C14H19NO2
Exact Mass: 233.14
Molecular Weight: 233.31
m/z: 233.14 (100.0%), 234.14 (15.5%), 235.15 (1.5%)

 

InChI:InChI=1S/C14H19NO2/c1-13(2)7-8-14(3,4)12-9-10(15(16)17)5-6-11(12)13/h5-6,9H,7-8H2,1-4H3

InChI Key:ZABFOFGWNHHHOO-UHFFFAOYSA-N

Canonical SMILES:CC1(CCC(C2=C1C=CC(=C2)[N+](=O)[O-])(C)C)C

 

Thermal Properties Value Condition Note
Melting Point 71-72 °C Solv: methanol (67-56-1) (2)IC
Melting Point 46-50 °C   (3)IC
Melting Point 46-50 °C   (4)IC

Specification

98%
References
  1. (2) Kagechika, Hiroyuki; Journal of Medicinal Chemistry 1988, V31(11), P2182-92 CAPLUS
  2. (3) Janssen, Bernd; DE 3903988 A1 1990 CAPLUS
  3. (4) Janssen, Bernd; EP 386452 A1 1990 CAPLUS
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