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2-Amino-5-nitrobenzophenone

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Name

2-Amino-5-nitrobenzophenone

EINECS 217-207-9
CAS No. 1775-95-7 Density 1.333 g/cm3
PSA 88.91000 LogP 3.51240
Solubility 3 mg/L (20 °C) in water Melting Point 166-168 °C(lit.)
Formula C13H10N2O3
Boiling Point 478.1 °C at 760 mmHg
Molecular Weight 242.234 Flash Point 242.9 °C
Transport Information N/A Appearance yellow solid
Safety 26-37/39-36 Risk Codes 36/37/38-20/21/22
Molecular Structure Molecular Structure of 1775-95-7 (2-Amino-5-nitrobenzophenone) Hazard Symbols HarmfulXn,IrritantXi
Synonyms

Benzophenone,2-amino-5-nitro- (7CI,8CI);(2-Amino-5-nitrophenyl)phenylmethanone;Methanone,(2-amino-5-nitrophenyl)phenyl-;5-Nitro-2-aminobenzophenone;Ro 7-19990;2-amino-5-nitro benzophenone;

Article Data 34

2-Amino-5-nitrobenzophenone Chemical Properties

Structure of 2-Amino-5-nitrobenzophenone (CAS NO.1775-95-7):

IUPAC Name: (2-Amino-5-nitrophenyl)-phenylmethanone
Molecular Formula: C13H10N2O3
Molar mass: 242.2301 g/mol
Density: 1.333 g/cm3 
Melting Point: 166-168 °C(lit.)
Boiling Point: 478.1 °C at 760 mmHg 
Flash Point: 242.9 °C
Water Solubility: 3 mg/L (20 °C)
Index of Refraction: 1.657
Molar Refractivity: 66.82 cm3
Molar Volume: 181.6 cm3
Surface Tension: 61.2 dyne/cm 
Enthalpy of Vaporization: 74.21 kJ/mol
Vapour Pressure: 2.65E-09 mmHg at 25 °C
XLogP3-AA: 3
H-Bond Donor: 1
H-Bond Acceptor: 4
Rotatable Bond Count: 2
Tautomer Count: 4
Exact Mass: 242.069142
MonoIsotopic Mass: 242.069142
Topological Polar Surface Area: 86.2
Heavy Atom Count: 18 
Canonical SMILES: C1=CC=C(C=C1)C(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N
InChI: InChI=1S/C13H10N2O3/c14-12-7-6-10(15(17)18)8-11(12)13(16)9-4-2-1-3-5-9/h1-8H,14H2
InChIKey: PZPZDEIASIKHPY-UHFFFAOYSA-N
EINECS: 217-207-9
Product Categories: FINE Chemical & INTERMEDIATES; Aromatic Benzophenones & Derivatives (substituted); Various Metabolites and Impurities; Nitrazepam; Intermediates & Fine Chemicals; Metabolites & Impurities; Pharmaceuticals; C13 to C14; Carbonyl Compounds; Ketones

2-Amino-5-nitrobenzophenone Uses

 2-Amino-5-nitrobenzophenone (CAS NO.1775-95-7) can be used as pharmaceutical intermediates.

2-Amino-5-nitrobenzophenone Toxicity Data With Reference

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 1gm/kg (1000mg/kg)   Biological Memoirs. Vol. 11, Pg. 192, 1985.

2-Amino-5-nitrobenzophenone Safety Profile

Hazard Codes: IrritantXi, HarmfulXn
Risk Statements: 36/37/38-20/21/22 
R36/37/38:Irritating to eyes, respiratory system and skin. 
R20/21/22:Harmful by inhalation, in contact with skin and if swallowed.
Safety Statements: 26-37/39-36 
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. 
S37/39:Wear suitable gloves and eye/face protection. 
S36:Wear suitable protective clothing.
WGK Germany: 3
RTECS: PC4935000

2-Amino-5-nitrobenzophenone Specification

 2-Amino-5-nitrobenzophenone (CAS NO.1775-95-7) is also named as (2-Amino-5-nitrophenyl)phenylmethanone ; 4-14-00-00246 (Beilstein Handbook Reference) ; BRN 0748830 ; Methanone, (2-amino-5-nitrophenyl)phenyl- . 2-Amino-5-nitrobenzophenone (CAS NO.1775-95-7) is yellow solid.

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