CAS 1775-95-7 2-Amino-5-nitrobenzophenone (HCID 15681)

Namen und Bezeichner

Bevorzugter Name: 2-Amino-5-nitrobenzophenone
IUPAC: (2-amino-5-nitrophenyl)-phenylmethanone
Lokaler Name: 2-Amino-5-nitrobenzophenon
Englischer Name: 2-Amino-5-nitrobenzophenone
Summenformel: C13H10N2O3
Molmasse: 242.23

Namen und Synonyme

2-Amino-5-nitrobenzophenone1775-95-7METHANONE, (2-AMINO-5-NITROPHENYL)PHENYL-(2-Amino-5-nitrophenyl)phenylmethanoneG2X8PCQ4GYDTXSID40170317RefChem:464652DTXCID7092808217-207-9(2-amino-5-nitrophenyl)(phenyl)methanone2-benzoyl-4-nitroaniline(2-amino-5-nitrophenyl)-phenylmethanone

Weitere Namen anzeigen

Ro 7-1999Ro 7-19990TIMTEC-BB SBB000821IFLAB-BB F0266-0701Nitrazepam Impurity 2Nitrazepam Impurity BCiclopirox Impurity 6LABOTEST-BB LT00000253

5-AMINO-2-NITROBENZOPHENONE5-Nitro-2-aminobenzophenoneMFCD00007364Benzophenone, 2-amino-5-nitro-2-amino-5-nitrophenyl phenyl ketoneEINECS 217-207-9Nitrazepam EP Impurity BBRN 0748830

Datenbank-Bezeichner

CAS: 1775-95-7
PubChem CID: 15681
DTXSID: DTXSID40170317
UNII: G2X8PCQ4GY
EC Number: 217-207-9
Nikkaji: J80.313H

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 3
Polarare Oberfläche (TPSA): 88,9 Å²
H-Brücken-Donoren: 1
H-Brücken-Akzeptoren: 4
Frei drehbare Bindungen: 2
Schwere Atome: 18
Formalladung: 0
Komplexität: 321

Experimentelle und physikochemische Eigenschaften

Kovats Retention Index · 2 Einträge

2365；2390；2380；2388；2388

2365

Physikochemische Eigenschaften

Schmelzpunkt: 166 · 166-168 °C (lit.)
Siedepunkt: 385.05 °C · 385.05°C (rough estimate)
Dichte: 1.248 · 1.2480 (rough estimate)
Brechungsindex: 1.53 · 1.5300 (estimate)
storage temp.: Keep in dark place,Inert atmosphere,Room temperature
Löslichkeit: Chloroform (Slightly), DMSO (Slightly), Methanol (Slightly, Heated)
Aggregatzustand: Solid
pka: -2.26 · -2.26±0.36(Predicted)
Farbe: Beige
Wasserlöslichkeit: 3 mg/L · 3 mg/L (20 C)
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
SMILES: C(C1=CC([N+]([O-])=O)=CC=C1N)(C1=CC=CC=C1)=O
CAS Datenbank: 1775 · 1775-95-7(CAS DataBase Reference)
NIST chemische Informationen: Methanone, (2-amino-5-nitrophenyl)phenyl-(1775-95-7)

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

Warning

H315 (97.9%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (97.9%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (95.8%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 48 reports by companies from 8 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

Gefahrenhinweise

Regulatory Information · 2 Einträge

Status: Active Update: 16-03-2018 https://echa.europa.eu/registration-dossier/-/registered-dossier/23260

Methanone, (2-amino-5-nitrophenyl)phenyl-: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.

Hazard Classes and CategoriesSkin Irrit. 2 (97.9%)；Eye Irrit. 2 (97.9%)；STOT SE 3 (95.8%)

Regulatorische Informationen

Regulatory Information · 2 Einträge

Status: Active Update: 16-03-2018 https://echa.europa.eu/registration-dossier/-/registered-dossier/23260

Methanone, (2-amino-5-nitrophenyl)phenyl-: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.

Sicherheitsdaten

wgk: 3
hs_code: 29223990
RTECS-Nr.: PC4935000
risk_code: 36/37/38-20/21/22
hazard_code: Xi,Xn
safety_code: 26-37/39-36
Speicherklasse: 11 - Combustible Solids
Hazard Classifications: Eye Irrit. 2Skin Irrit. 2STOT SE 3

Chemie und Industrie

Anwendungen

Verwenden2-Amino-5-nitrobenzophenone was used in the synthesis of [5-(4-nitrophenyl)-2-furyl]acrylic acid substituted benzophenone (anti-malarial agent).

Vor- und nachgelagerte Produkte

Vorgelagerte Rohstoffe

N-Methyl-4-nitroanilin Zinkchlorid 4-Chlorbenzoesure Benzophenon Diphenylamin Benzoylchlorid Acetamide, N-(2-benzoyl-4-nitrophenyl)-Acetamide, 2-amino-N-(2-benzoyl-4-nitrophenyl)-Methanone, (2-iodo-5-nitrophenyl)phenyl-2-Amino-5-nitrobenzonitril 4'-Nitrobenzanilid 2-Chlor-5-nitrobenzophenon

Nachgelagerte Produkte

N-(2-Benzoyl-4-nitrophenyl)-2-chloracetamid Nitrazepam 4-Amino-3-nitrobenzophenon 3-Acetyl-6-nitro-4-phenylquinolin-2(1H)-one

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成都彼样生物科技有限公司18108052721 · [email protected]

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HRID 267406als Eduktuspto-grants-1976_03

HRID 312348als EduktTraining data from https://doi.org/10.1039/C8SC04228D (8/10)

HRID 570377als Eduktuspto-grants-2015_05

HRID 570381als Eduktuspto-grants-2015_05

HRID 570385als Eduktuspto-grants-2015_05

HRID 919176als Eduktuspto-grants-2016_03

HRID 1595011als Eduktuspto-grants-2001_09

HRID 1625689als Eduktuspto-grants-2014_07

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