9-Chloro-10-nitro-9,10-dihydroanthracene
Basic information
- CAS
36101-18-5- Standard SMILES
O=[N+]([O-])C1c2ccccc2C(Cl)c2ccccc21- InChIKey
IJHINNYNYMRJDP-UHFFFAOYSA-N- Molecular formula
- C14H10ClNO2
- Average molar mass
- 259.69 g/mol
- Monoisotopic mass
- 259.0400063
Names & identifiers
- Preferred name
- 9-Chloro-10-nitro-9,10-dihydroanthracene
- IUPAC
- 9-chloro-10-nitro-9,10-dihydroanthracene
- English name
- NSC24088
- Molecular formula
- C14H10ClNO2
- Molecular weight
- 259.69
Names & synonyms
9-chloro-10-nitro-9,10-dihydroanthracene36101-18-5NSC24088SCHEMBL6142061DTXSID30282074Anthracene,10-dihydro-10-nitro-NSC-24088DB-0693139-chloro-10-nitro-9,10-dihydro-anthracene9-chloro-9,10-dihydro-10-nitroAnthraceneAnthracene, 9-chloro-9,10-dihydro-10-nitro-acetic acid [3,4-diacetyloxy-5-(6-amino-8-bromo-9-purinyl)-2-oxolanyl]methyl ester
Database identifiers
- CAS
36101-18-5- PubChem CID
- 229963
- DTXSID
DTXSID30282074
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 45.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 306
Physicochemical properties
- Boiling point
- 410.4 · 410.4±45.0 °C(Predicted)
- Density
- 1.37 · 1.37±0.1 g/cm3(Predicted)
- pka
- 4.47 · 4.47±0.40(Predicted)
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Related reactions
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Compound notes
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