Home Other Building Blocks METHYL 4-(4-FLUOROPHENOXY)-3-NITROBENZENECARBOXYLATE

METHYL 4-(4-FLUOROPHENOXY)-3-NITROBENZENECARBOXYLATE

CAS No.:
320417-11-6
Catalog Number:
AG00BYQ5
Molecular Formula:
C14H10FNO5
Molecular Weight:
291.2313
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Product Description
Catalog Number:
AG00BYQ5
Chemical Name:
METHYL 4-(4-FLUOROPHENOXY)-3-NITROBENZENECARBOXYLATE
CAS Number:
320417-11-6
Molecular Formula:
C14H10FNO5
Molecular Weight:
291.2313
MDL Number:
MFCD00138765
IUPAC Name:
methyl 4-(4-fluorophenoxy)-3-nitrobenzoate
InChI:
InChI=1S/C14H10FNO5/c1-20-14(17)9-2-7-13(12(8-9)16(18)19)21-11-5-3-10(15)4-6-11/h2-8H,1H3
InChI Key:
VOPSYKKSSYANRA-UHFFFAOYSA-N
SMILES:
COC(=O)c1ccc(c(c1)[N+](=O)[O-])Oc1ccc(cc1)F
Properties
Complexity:
378  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
291.054g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
291.234g/mol
Monoisotopic Mass:
291.054g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
81.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2  
Properties