Home Other Building Blocks Methyl 3-fluoro-4-iodobenzoate

Methyl 3-fluoro-4-iodobenzoate

CAS No.:
1027513-46-7
Catalog Number:
AG0008A1
Molecular Formula:
C8H6FIO2
Molecular Weight:
280.0349
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
1 week
United States
$130
- +
5g
95%
1 week
United States
$246
- +
25g
95%
1 week
United States
$864
- +
Product Description
Catalog Number:
AG0008A1
Chemical Name:
Methyl 3-fluoro-4-iodobenzoate
CAS Number:
1027513-46-7
Molecular Formula:
C8H6FIO2
Molecular Weight:
280.0349
MDL Number:
MFCD09800728
IUPAC Name:
methyl 3-fluoro-4-iodobenzoate
InChI:
InChI=1S/C8H6FIO2/c1-12-8(11)5-2-3-7(10)6(9)4-5/h2-4H,1H3
InChI Key:
QLOABIRBPCIWKQ-UHFFFAOYSA-N
SMILES:
COC(=O)c1ccc(c(c1)F)I
Properties
Complexity:
174  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
279.94g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
280.037g/mol
Monoisotopic Mass:
279.94g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Properties