Home Other Building Blocks methyl 3-(difluoromethoxy)-4-iodobenzoate

methyl 3-(difluoromethoxy)-4-iodobenzoate

CAS No.:
2138515-41-8
Catalog Number:
AG01ELE8
Molecular Formula:
C9H7F2IO3
Molecular Weight:
328.0514
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Product Description
Catalog Number:
AG01ELE8
Chemical Name:
methyl 3-(difluoromethoxy)-4-iodobenzoate
CAS Number:
2138515-41-8
Molecular Formula:
C9H7F2IO3
Molecular Weight:
328.0514
MDL Number:
MFCD31558722
IUPAC Name:
methyl 3-(difluoromethoxy)-4-iodobenzoate
InChI:
InChI=1S/C9H7F2IO3/c1-14-8(13)5-2-3-6(12)7(4-5)15-9(10)11/h2-4,9H,1H3
InChI Key:
IFFZBPZURIWOGR-UHFFFAOYSA-N
SMILES:
COC(=O)c1ccc(c(c1)OC(F)F)I
Properties
Complexity:
225  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
327.941g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
328.053g/mol
Monoisotopic Mass:
327.941g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3  
Properties