Bis(4-nitrophenyl) phosphate

Modify Date: 2026-06-30 15:49:45

Bis(4-nitrophenyl) phosphate Structure
Bis(4-nitrophenyl) phosphate structure
Common Name Bis(4-nitrophenyl) phosphate
CAS Number 645-15-8 Molecular Weight 340.182
Density 1.6±0.1 g/cm3 Boiling Point 545.7±60.0 °C at 760 mmHg
Molecular Formula C12H9N2O8P Melting Point 172-175 °C(lit.)
MSDS Chinese USA Flash Point 283.8±32.9 °C
Symbol GHS06
GHS06
Signal Word Danger

 Names

Name Bis(4-nitrophenyl) phosphate
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.6±0.1 g/cm3
Boiling Point 545.7±60.0 °C at 760 mmHg
Melting Point 172-175 °C(lit.)
Molecular Formula C12H9N2O8P
Molecular Weight 340.182
Flash Point 283.8±32.9 °C
Exact Mass 340.009644
PSA 157.21000
LogP 1.70
Vapour Pressure 0.0±1.5 mmHg at 25°C
Index of Refraction 1.642
InChIKey MHSVUSZEHNVFKW-UHFFFAOYSA-N
SMILES O=[N+]([O-])c1ccc(OP(=O)(O)Oc2ccc([N+](=O)[O-])cc2)cc1

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
TB8260000
CHEMICAL NAME :
Phosphoric acid, bis(p-nitrophenyl) ester
CAS REGISTRY NUMBER :
645-15-8
BEILSTEIN REFERENCE NO. :
2064857
LAST UPDATED :
199710
DATA ITEMS CITED :
5
MOLECULAR FORMULA :
C12-H9-N2-O8-P

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
410 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
HSZPAZ Hoppe-Seyler's Zeitschrift fuer Physiologische Chemie. (Walter de Gruyter, Inc., 200 Saw Mill River Rd., Hawthorne, NY 10532) V.21- 1895/96- Volume(issue)/page/year: 348,609,1967 *** NIOSH STANDARDS DEVELOPMENT AND SURVEILLANCE DATA *** NIOSH OCCUPATIONAL EXPOSURE SURVEY DATA : NOES - National Occupational Exposure Survey (1983) NOES Hazard Code - X9818 No. of Facilities: 72 (estimated) No. of Industries: 1 No. of Occupations: 1 No. of Employees: 1005 (estimated) No. of Female Employees: 698 (estimated)

 Safety Information

Symbol GHS06
GHS06
Signal Word Danger
Hazard Statements H300
Precautionary Statements P264-P301 + P310
Personal Protective Equipment Eyeshields;Faceshields;Gloves;type P2 (EN 143) respirator cartridges
Hazard Codes T:Toxic;
Risk Phrases R25
Safety Phrases S45
RIDADR UN 2811 6.1/PG 3
WGK Germany 3
RTECS TB8260000

 Synthetic Route

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Bis(4-nitrophenyl) phosphate Structure

Bis(4-nitrophen...

CAS#:645-15-8

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Literature: Chemistry Letters, , # 3 p. 211 - 212

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Bis(4-nitrophenyl) phosphate Structure

Bis(4-nitrophen...

CAS#:645-15-8

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Literature: Journal of the Chemical Society, , p. 1234,1239

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Bis(4-nitrophenyl) phosphate Structure

Bis(4-nitrophen...

CAS#:645-15-8

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Literature: Recueil des Travaux Chimiques des Pays-Bas, , vol. 36, p. 51,57, 62

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Bis(4-nitrophenyl) phosphate Structure

Bis(4-nitrophen...

CAS#:645-15-8

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Literature: Chemische Berichte, , vol. 44, p. 3417

~%

Bis(4-nitrophenyl) phosphate Structure

Bis(4-nitrophen...

CAS#:645-15-8

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Literature: Recueil des Travaux Chimiques des Pays-Bas, , vol. 36, p. 51,57, 62

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 Bis(4-nitrophenyl) phosphateBioassay

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Name: Luminescence-based cell-based primary high throughput screening assay to identify ago...
Source: The Scripps Research Institute Molecular Screening Center
Target: mu-type opioid receptor isoform MOR-1 [Homo sapiens]
External Id: OPRM1-OPRD1_AG_LUMI_1536_1X%ACT PRUN
Name: QFRET-based biochemical primary high throughput screening assay to identify exosite i...
Source: The Scripps Research Institute Molecular Screening Center
Target: disintegrin and metalloproteinase domain-containing protein 17 preproprotein [Homo sapiens]
External Id: ADAM17_INH_QFRET_1536_1X%INH PRUN
Name: Fluorescence-based cell-based primary high throughput screening assay to identify ago...
Source: The Scripps Research Institute Molecular Screening Center
Target: muscarinic acetylcholine receptor M1 [Homo sapiens]
External Id: CHRM1_AG_FLUO8_1536_1X%ACT PRUN
Name: Antioxidant activity assessed as ABTS radical cation scavenging activity after 1 hr b...
Source: ChEMBL
Target: N/A
External Id: CHEMBL4047919
Name: Inhibition of human erythrocyte AChE at 20 uM using acetylthiocholine iodide as subst...
Source: ChEMBL
Target: Acetylcholinesterase
External Id: CHEMBL4047920
Name: Antioxidant activity assessed as ABTS radical cation scavenging activity by measuring...
Source: ChEMBL
Target: N/A
External Id: CHEMBL4047918
Name: Inhibition of pig liver carboxylesterase using 4-nitrophenol acetate as substrate by ...
Source: ChEMBL
Target: Liver carboxylesterase
External Id: CHEMBL4047915
Name: Fluorescence polarization to screen for inhibitor that competite the binding of FadD2...
Source: Broad Institute
Target: FATTY-ACID-CoA LIGASE FADD28 (FATTY-ACID-CoA SYNTHETASE)
External Id: 2147-01_Inhibitor_SinglePoint_HTS_Activity
Name: Bursicon-induced LGR2 mediated cAMP production in LGR-2/CRE6x-Luciferase co-transfect...
Source: Broad Institute
Target: N/A
External Id: Bursicon-induced LGR2 mediated cAMP production in LGR-2/CRE6x-Luciferase co-transfected HEK293 cells Inhibition - 7011-01_Antagonist_SinglePoint_HTS_Activity
Name: Inhibition of DLODP in human HepG2 microsomal membrane assessed as reduction in [3H]O...
Source: ChEMBL
Target: N/A
External Id: CHEMBL4042269
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 Synonyms

Bis(4-nitrophenyl)phosphate
p-nitro-phenohydrogenphosphate
bnpp
Phosphoric acid, bis(4-nitrophenyl) ester
MFCD00007318
Phosphoric acid, bis(p-nitrophenyl) ester
Di-p-nitrophenyl phosphate
Bis(4-nitrophenyl) hydrogen phosphate
Di-4-nitrophenyl phosphate
Bis(p-nitrophenyl)phosphate
DI-P-NITROPHENYLPHOSPHORIC ACID
EINECS 211-434-7
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