2-Propen-1-ol, 3-(4-methoxyphenyl)-2-nitro-, acetate (ester)

Base Information

• Chemical Name: 2-Propen-1-ol, 3-(4-methoxyphenyl)-2-nitro-, acetate (ester)
• CAS No.: 77834-88-9
• Molecular Formula: C12H13NO5
• Molecular Weight: 251.239
• Nikkaji Number: J385.131A

Synonyms:2-Propen-1-ol, 3-(4-methoxyphenyl)-2-nitro-, acetate (ester);77834-88-9;Acetic acid 2-nitro-3-[4-methoxyphenyl]-2-propenyl ester

Chemical Property of 2-Propen-1-ol, 3-(4-methoxyphenyl)-2-nitro-, acetate (ester)

Chemical Property:

• Vapor Pressure: 2.65E-07mmHg at 25°C
• Boiling Point: 421.2°C at 760 mmHg
• Flash Point: 190.7°C
• Density: 1.234g/cm³
• XLogP3: 1.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 5
• Exact Mass: 251.07937252
• Heavy Atom Count: 18
• Complexity: 326

Purity/Quality:

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=O)OCC(=CC1=CC=C(C=C1)OC)[N+](=O)[O-]
• Isomeric SMILES: CC(=O)OC/C(=C/C1=CC=C(C=C1)OC)/[N+](=O)[O-]

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