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886509-99-5

886509-99-5 | 1-Bromo-5-(difluoromethyl);-2-fluorobenzene

CAS No: 886509-99-5 Catalog No: AG003E58 MDL No:MFCD08276255

Product Description

Catalog Number:
AG003E58
Chemical Name:
1-Bromo-5-(difluoromethyl);-2-fluorobenzene
CAS Number:
886509-99-5
Molecular Formula:
C7H4BrF3
Molecular Weight:
225.0059
MDL Number:
MFCD08276255
IUPAC Name:
2-bromo-4-(difluoromethyl)-1-fluorobenzene
InChI:
InChI=1S/C7H4BrF3/c8-5-3-4(7(10)11)1-2-6(5)9/h1-3,7H
InChI Key:
SKVRXULNDBZCFL-UHFFFAOYSA-N
SMILES:
FC(c1ccc(c(c1)Br)F)F

Properties

Complexity:
129  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
223.945g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
225.008g/mol
Monoisotopic Mass:
223.945g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3  

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