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Home > Nitro Compounds > 125038-81-5
125038-81-5 | Benzene, 1-ethenyl-4-[(4-nitrophenoxy)methyl]-
CAS No: 125038-81-5 Catalog No: AG000N07 MDL No:
Product Description
Catalog Number:
AG000N07
Chemical Name:
Benzene, 1-ethenyl-4-[(4-nitrophenoxy)methyl]-
CAS Number:
125038-81-5
Molecular Formula:
C15H13NO3
Molecular Weight:
255.2686
IUPAC Name:
1-ethenyl-4-[(4-nitrophenoxy)methyl]benzene
InChI:
InChI=1S/C15H13NO3/c1-2-12-3-5-13(6-4-12)11-19-15-9-7-14(8-10-15)16(17)18/h2-10H,1,11H2
InChI Key:
LWNKCBXQZWPEFP-UHFFFAOYSA-N
SMILES:
C=Cc1ccc(cc1)COc1ccc(cc1)[N+](=O)[O-]
Properties
Complexity:
297
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
255.09g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
255.273g/mol
Monoisotopic Mass:
255.09g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
55A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4
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