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N-(4-Methoxybenzylidene)-4-acetoxyaniline - 98%, high purity , CAS No.10484-13-6
Basic Description
Synonyms | 1(2H)-Naphthalenone, 6-fluoro-3,4-dihydro- | OH-PEG2-TBA | Anisylidene-p-aminophenyl acetate | Cinnamic acid, p-methoxy-, p-aminophenyl ester | N-(p-Methoxybenzylidene)-p-aminophenyl acetate | Phenol, 4-[[(4-methoxyphenyl)methylene]amino]-, acetate (ester |
Specifications & Purity | ≥98% |
Shipped In | Normal |
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Names and Identifiers
IUPAC Name | [4-[(4-methoxyphenyl)methylideneamino]phenyl] acetate |
INCHI | InChI=1S/C16H15NO3/c1-12(18)20-16-9-5-14(6-10-16)17-11-13-3-7-15(19-2)8-4-13/h3-11H,1-2H3 |
InChi Key | HOYWVKUPOCFKOT-UHFFFAOYSA-N |
Canonical SMILES | CC(=O)OC1=CC=C(C=C1)N=CC2=CC=C(C=C2)OC |
Isomeric SMILES | CC(=O)OC1=CC=C(C=C1)N=CC2=CC=C(C=C2)OC |
PubChem CID | 97495 |
Molecular Weight | 269.3 |
Reaxy-Rn | 2811423 |
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Certificates(CoA,COO,BSE/TSE and Analysis Chart)
Chemical and Physical Properties
Solubility | Soluble in Methanol |
Molecular Weight | 269.290 g/mol |
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XLogP3 | 2.800 |
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Hydrogen Bond Donor Count | 0 |
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Hydrogen Bond Acceptor Count | 4 |
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Rotatable Bond Count | 5 |
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Exact Mass | 269.105 Da |
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Monoisotopic Mass | 269.105 Da |
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Topological Polar Surface Area | 47.900 Ų |
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Heavy Atom Count | 20 |
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Formal Charge | 0 |
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Complexity | 327.000 |
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Isotope Atom Count | 0 |
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Defined Atom Stereocenter Count | 0 |
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Undefined Atom Stereocenter Count | 0 |
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Defined Bond Stereocenter Count | 0 |
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Undefined Bond Stereocenter Count | 0 |
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The total count of all stereochemical bonds | 0 |
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Covalently-Bonded Unit Count | 1 |
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Safety and Hazards(GHS)
Pictogram(s) | GHS07 |
Signal | Warning |
Hazard Statements | H315:Causes skin irritation H319:Causes serious eye irritation |
Precautionary Statements | P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses if present and easy to do - continue rinsing. P280:Wear protective gloves/protective clothing/eye protection/face protection. P302+P352:IF ON SKIN: wash with plenty of water. P321:Specific treatment (see ... on this label). P264:Wash hands [and …] thoroughly after handling. P362+P364:Take off contaminated clothing and wash it before reuse. P264+P265:Wash hands [and …] thoroughly after handling. Do not touch eyes. P337+P317:If eye irritation persists: Get medical help. P332+P317:If skin irritation occurs: Get medical help. |
Reaxy-Rn | 2811423 |
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