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1233958-30-9

1233958-30-9 | 4-Fluoro-N-(3-methoxypropyl)-2-nitroaniline

CAS No: 1233958-30-9 Catalog No: AG01FAVH MDL No:

Product Description

Catalog Number:
AG01FAVH
Chemical Name:
4-Fluoro-N-(3-methoxypropyl)-2-nitroaniline
CAS Number:
1233958-30-9
Molecular Formula:
C10H13FN2O3
Molecular Weight:
228.2202
IUPAC Name:
4-fluoro-N-(3-methoxypropyl)-2-nitroaniline
InChI:
InChI=1S/C10H13FN2O3/c1-16-6-2-5-12-9-4-3-8(11)7-10(9)13(14)15/h3-4,7,12H,2,5-6H2,1H3
InChI Key:
NURFPKSLGBCWOM-UHFFFAOYSA-N
SMILES:
COCCCNc1ccc(cc1[N+](=O)[O-])F

Properties

Complexity:
223  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
228.091g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
228.223g/mol
Monoisotopic Mass:
228.091g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
67.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  

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