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2303-25-5

2303-25-5 | Benzene, 1-methyl-3-(4-nitrophenoxy)-

CAS No: 2303-25-5 Catalog No: AG002LXZ MDL No:

Product Description

Catalog Number:
AG002LXZ
Chemical Name:
Benzene, 1-methyl-3-(4-nitrophenoxy)-
CAS Number:
2303-25-5
Molecular Formula:
C13H11NO3
Molecular Weight:
229.2313
IUPAC Name:
1-methyl-3-(4-nitrophenoxy)benzene
InChI:
InChI=1S/C13H11NO3/c1-10-3-2-4-13(9-10)17-12-7-5-11(6-8-12)14(15)16/h2-9H,1H3
InChI Key:
DLKBRTKDSDXWNA-UHFFFAOYSA-N
SMILES:
Cc1cccc(c1)Oc1ccc(cc1)[N+](=O)[O-]

Properties

Complexity:
256  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.074g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
229.235g/mol
Monoisotopic Mass:
229.074g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
55A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9  

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