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54509-63-6

54509-63-6 | 4-BROMO-1-BUTOXY-2-FLUOROBENZENE

CAS No: 54509-63-6 Catalog No: AG00DKPM MDL No:MFCD09907658

Product Description

Catalog Number:
AG00DKPM
Chemical Name:
4-BROMO-1-BUTOXY-2-FLUOROBENZENE
CAS Number:
54509-63-6
Molecular Formula:
C10H12BrFO
Molecular Weight:
247.1041
MDL Number:
MFCD09907658
IUPAC Name:
4-bromo-1-butoxy-2-fluorobenzene
InChI:
InChI=1S/C10H12BrFO/c1-2-3-6-13-10-5-4-8(11)7-9(10)12/h4-5,7H,2-3,6H2,1H3
InChI Key:
NCNAZASEERQBRT-UHFFFAOYSA-N
SMILES:
CCCCOc1ccc(cc1F)Br

Properties

Complexity:
143  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
246.006g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
247.107g/mol
Monoisotopic Mass:
246.006g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9  

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