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452-74-4

452-74-4 | 1-Bromo-2-fluoro-4-methylbenzene

CAS No: 452-74-4 Catalog No: AG003KY8 MDL No:MFCD00040940

Product Description

Catalog Number:
AG003KY8
Chemical Name:
1-Bromo-2-fluoro-4-methylbenzene
CAS Number:
452-74-4
Molecular Formula:
C7H6BrF
Molecular Weight:
189.0249
MDL Number:
MFCD00040940
IUPAC Name:
1-bromo-2-fluoro-4-methylbenzene
InChI:
InChI=1S/C7H6BrF/c1-5-2-3-6(8)7(9)4-5/h2-4H,1H3
InChI Key:
SLFNGVGRINFJLK-UHFFFAOYSA-N
SMILES:
Cc1ccc(c(c1)F)Br

Properties

Complexity:
94.9  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
187.964g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
189.027g/mol
Monoisotopic Mass:
187.964g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  

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