Home Halogens 2-(bromomethyl)-4-methoxy-1-(trifluoromethoxy)benzene

2-(bromomethyl)-4-methoxy-1-(trifluoromethoxy)benzene

CAS No.:
1261839-94-4
Catalog Number:
AG01C16T
Molecular Formula:
C9H8BrF3O2
Molecular Weight:
285.0578
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Product Description
Catalog Number:
AG01C16T
Chemical Name:
2-(bromomethyl)-4-methoxy-1-(trifluoromethoxy)benzene
CAS Number:
1261839-94-4
Molecular Formula:
C9H8BrF3O2
Molecular Weight:
285.0578
MDL Number:
MFCD18398487
IUPAC Name:
2-(bromomethyl)-4-methoxy-1-(trifluoromethoxy)benzene
InChI:
InChI=1S/C9H8BrF3O2/c1-14-7-2-3-8(6(4-7)5-10)15-9(11,12)13/h2-4H,5H2,1H3
InChI Key:
BLCMWABUEGRNRF-UHFFFAOYSA-N
SMILES:
BrCc1cc(OC)ccc1OC(F)(F)F
Properties
Complexity:
198  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
283.966g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
285.06g/mol
Monoisotopic Mass:
283.966g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6  
Properties