Home Other Building Blocks 1,4-difluoro-2-isocyanato-5-methoxybenzene

1,4-difluoro-2-isocyanato-5-methoxybenzene

CAS No.:
1261645-82-2
Catalog Number:
AG019ZDI
Molecular Formula:
C8H5F2NO2
Molecular Weight:
185.1276
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Product Description
Catalog Number:
AG019ZDI
Chemical Name:
1,4-difluoro-2-isocyanato-5-methoxybenzene
CAS Number:
1261645-82-2
Molecular Formula:
C8H5F2NO2
Molecular Weight:
185.1276
MDL Number:
MFCD18395262
IUPAC Name:
1,4-difluoro-2-isocyanato-5-methoxybenzene
InChI:
InChI=1S/C8H5F2NO2/c1-13-8-3-5(9)7(11-4-12)2-6(8)10/h2-3H,1H3
InChI Key:
ZTPBHFHZVDVDSK-UHFFFAOYSA-N
SMILES:
O=C=Nc1cc(F)c(cc1F)OC
Properties
Complexity:
218  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
185.029g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
185.13g/mol
Monoisotopic Mass:
185.029g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
38.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Properties