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54788-19-1

54788-19-1 | 1-(bromomethyl)-2-fluoro-4-methoxybenzene

CAS No: 54788-19-1 Catalog No: AG0037NA MDL No:MFCD09261045

Product Description

Catalog Number:
AG0037NA
Chemical Name:
1-(bromomethyl)-2-fluoro-4-methoxybenzene
CAS Number:
54788-19-1
Molecular Formula:
C8H8BrFO
Molecular Weight:
219.0509
MDL Number:
MFCD09261045
IUPAC Name:
1-(bromomethyl)-2-fluoro-4-methoxybenzene
InChI:
InChI=1S/C8H8BrFO/c1-11-7-3-2-6(5-9)8(10)4-7/h2-4H,5H2,1H3
InChI Key:
MGGMXOCLNXDSEQ-UHFFFAOYSA-N
SMILES:
COc1ccc(c(c1)F)CBr

Properties

Complexity:
121  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
217.974g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
219.053g/mol
Monoisotopic Mass:
217.974g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  

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