4-(4-Chlorophenoxy)aniline structure
|
Common Name | 4-(4-Chlorophenoxy)aniline | ||
|---|---|---|---|---|
| CAS Number | 101-79-1 | Molecular Weight | 219.667 | |
| Density | 1.3±0.1 g/cm3 | Boiling Point | 349.8±22.0 °C at 760 mmHg | |
| Molecular Formula | C12H10ClNO | Melting Point | 101 °C | |
| MSDS | Chinese USA | Flash Point | 165.3±22.3 °C | |
| Symbol |
GHS05, GHS07 |
Signal Word | Danger | |
| Name | 4-Amino-4'-chlorodiphenyl ether |
|---|---|
| Synonym | More Synonyms |
| Density | 1.3±0.1 g/cm3 |
|---|---|
| Boiling Point | 349.8±22.0 °C at 760 mmHg |
| Melting Point | 101 °C |
| Molecular Formula | C12H10ClNO |
| Molecular Weight | 219.667 |
| Flash Point | 165.3±22.3 °C |
| Exact Mass | 219.045090 |
| PSA | 35.25000 |
| LogP | 2.96 |
| Vapour Pressure | 0.0±0.8 mmHg at 25°C |
| Index of Refraction | 1.628 |
| InChIKey | YTISFYMPVILQRL-UHFFFAOYSA-N |
| SMILES | Nc1ccc(Oc2ccc(Cl)cc2)cc1 |
CHEMICAL IDENTIFICATION
HEALTH HAZARD DATAACUTE TOXICITY DATA
MUTATION DATA
|
| Symbol |
GHS05, GHS07 |
|---|---|
| Signal Word | Danger |
| Hazard Statements | H302-H315-H317-H318-H335 |
| Precautionary Statements | P261-P280-P305 + P351 + P338 |
| Personal Protective Equipment | dust mask type N95 (US);Eyeshields;Faceshields;Gloves |
| Hazard Codes | Xi: Irritant;Xn: Harmful; |
| Risk Phrases | R36/37/38 |
| Safety Phrases | S26-S36/37/39-S36/37 |
| RIDADR | NONH for all modes of transport |
| RTECS | BX1770000 |
| HS Code | 2922299090 |
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4-(4-Chlorophen... CAS#:101-79-1 |
| Literature: Journal of Medicinal Chemistry, , vol. 56, # 11 p. 4811 - 4815 |
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| Literature: Bioorganic and Medicinal Chemistry, , vol. 12, # 16 p. 4477 - 4492 |
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4-(4-Chlorophen... CAS#:101-79-1 |
| Literature: Bioorganic and Medicinal Chemistry, , vol. 12, # 16 p. 4477 - 4492 |
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4-(4-Chlorophen... CAS#:101-79-1 |
| Literature: Pharmazie, , vol. 35, # 2 p. 78 - 80 |
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4-(4-Chlorophen... CAS#:101-79-1 |
| Literature: Chemical and Pharmaceutical Bulletin, , vol. 34, # 2 p. 701 - 712 |
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4-(4-Chlorophen... CAS#:101-79-1 |
| Literature: WO2013/60029 A1, ; |
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4-(4-Chlorophen... CAS#:101-79-1 |
| Literature: US1890256 , ; |
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4-(4-Chlorophen... CAS#:101-79-1 |
| Literature: Journal of the Chemical Society, , p. 2367 |
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4-(4-Chlorophen... CAS#:101-79-1 |
| Literature: Journal of the Chemical Society, Perkin Transactions 2: Physical Organic Chemistry (1972-1999), , p. 1377 - 1382 |
| Precursor 8 | |
|---|---|
| DownStream 10 | |
| HS Code | 2922299090 |
|---|---|
| Summary | 2922299090. other amino-naphthols and other amino-phenols, other than those containing more than one kind of oxygen function, their ethers and esters; salts thereof. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0% |
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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
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|
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: Cytochrome P450 Family 1 Subfamily A Member 2 (CYP1A2) small molecule antagonists: lu...
Source: 824
External Id: CYP273
|
|
Name: Fluorescence-based cell-based primary high throughput screening assay to identify pos...
Source: The Scripps Research Institute Molecular Screening Center
Target: muscarinic acetylcholine receptor M1 [Homo sapiens]
External Id: CHRM1_PAM_FLUO8_1536_1X%ACT PRUN
|
|
Name: Fluorescence polarization-based biochemical high throughput primary assay to identify...
Source: The Scripps Research Institute Molecular Screening Center
Target: RecName: Full=Sialate O-acetylesterase; AltName: Full=H-Lse; AltName: Full=Sialic acid-specific 9-O-acetylesterase; Flags: Precursor [Homo sapiens]
External Id: SIAE_INH_FP_1536_1X%INH PRUN
|
|
Name: p53 small molecule agonists, cell-based qHTS assay: qHTS cell viability counter scree...
Source: 824
Target: N/A
External Id: P53600
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|
Name: p53 small molecule agonists, cell-based qHTS assay with rat liver microsomes: qHTS ce...
Source: 824
Target: N/A
External Id: P53MS958
|
|
Name: p53 small molecule agonists, cell-based qHTS assay with rat liver microsomes: Summary
Source: 824
External Id: P53MS482
|
|
Name: p53 small molecule agonists, cell-based qHTS assay with human liver microsomes
Source: 824
Target: tumor suppressor p53 [Homo sapiens]
External Id: P53MS233
|
| 4-Amino-4'-chlorodiphenyl ether |
| 4-(4-Chlorophenoxy)aniline |
| MFCD00043925 |
| 4-Amino-4-Chlorodiphenyl Ether |
| EINECS 202-976-5 |