1-Nitroadamantane

HCID 64165

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Basic information

CAS: 7575-82-8
Standard SMILES: O=[N+]([O-])C12CC3CC(CC(C3)C1)C2
InChIKey: HONLSNLUVRQMEK-UHFFFAOYSA-N
Molecular formula: C10H15NO2
Average molar mass: 181.23 g/mol
Monoisotopic mass: 181.11027872

Names & identifiers

Preferred name: 1-Nitroadamantane
IUPAC: 1-nitroadamantane
English name: 1-NITROADAMANTANE
Molecular formula: C10H15NO2
Molecular weight: 181.23

Names & synonyms

1-Nitroadamantane7575-82-8DTXSID30226650RefChem:76582DTXCID60149141Adamantane, 1-nitro-nitroadamantaneMFCD01321099Tricyclo[3.3.1.1(3,7)]decane, 1-nitro-NSC 130990NSC 235788Tricyclo[3.3.1.13,7]decane, 1-nitro-

Show more names

1-NitroadamantaneQ: What is 1-Nitroadamantane Q: What is the CAS Number of 1-Nitroadamantane Q: What is the storage condition of 1-Nitroadamantane

tricyclo[3.3.1.1~3,7~]decane, 1-nitro-Tricyclo[3.3.1.13, 1-nitro-Tricyclo(3.3.1.13,7)decane, 1-nitro-1-Nitrotricyclo[3.3.1.13,7]decane; NSC130990; NSC2357881-NitroadamantaneQ: What isSCHEMBL1200529SCHEMBL8789410ALBB-013850

Database identifiers

CAS: 7575-82-8
PubChem CID: 64165
DTXSID: DTXSID30226650
Nikkaji: J132.961H

Properties

Computed structural properties

XLogP: 2.7
Topological polar surface area: 45.8 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 2
Rotatable bonds: 0
Heavy atoms: 13
Formal charge: 0
Complexity: 215

Experimental & physicochemical properties

Kovats Retention Index1500

Physicochemical properties

Melting point: 159 ℃ · 159℃
Boiling point: 277.1 · 277.1±7.0℃ (760 Torr)
Density: 1.19 · 1.19±0.1 g/cm3 (20 ºC 760 Torr)
Flash point: 121.8 · 121.8±11.0℃
storage temp.: -20 °C · -20°C Freezer, Under inert atmosphere
solubility: Chloroform (Slightly), Methanol (Sparingly)
form: Solid
color: White to Off-White
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 302 · H302-H315-H319-H335
Precautionary statements: 261 · P261-P305+P351+P338
HazardClass: IRRITANT

Safety & regulation

Safety data

Signal word: Warning
Symbol(GHS): GHS07
hazard_class: IRRITANT
Hazard statements: H302-H315-H319-H335
Precautionary statements: P261-P305+P351+P338

Chemistry & industry

Applications

Uses1-Nitroadamantane is a biologically active polycycloalkane that exhibits antiviral activities and as well as inhibitory activities towards the poliferation of lymphocytes.