Home Aminos methyl 3-amino-4-fluoro-5-iodobenzoate

methyl 3-amino-4-fluoro-5-iodobenzoate

CAS No.:
2092615-03-5
Catalog Number:
AG01ELBQ
Molecular Formula:
C8H7FINO2
Molecular Weight:
295.0496
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Product Description
Catalog Number:
AG01ELBQ
Chemical Name:
methyl 3-amino-4-fluoro-5-iodobenzoate
CAS Number:
2092615-03-5
Molecular Formula:
C8H7FINO2
Molecular Weight:
295.0496
MDL Number:
MFCD31665441
IUPAC Name:
methyl 3-amino-4-fluoro-5-iodobenzoate
InChI:
InChI=1S/C8H7FINO2/c1-13-8(12)4-2-5(10)7(9)6(11)3-4/h2-3H,11H2,1H3
InChI Key:
LNUXMWOMFBQQLR-UHFFFAOYSA-N
SMILES:
COC(=O)c1cc(N)c(c(c1)I)F
Properties
Complexity:
203  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
294.951g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
295.052g/mol
Monoisotopic Mass:
294.951g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
52.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Properties