Home Halogens 1-(3-chloroprop-1-yn-1-yl)-4-fluorobenzene

1-(3-chloroprop-1-yn-1-yl)-4-fluorobenzene

CAS No.:
1179597-72-8
Catalog Number:
AG01A1DR
Molecular Formula:
C9H6ClF
Molecular Weight:
168.5953
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Product Description
Catalog Number:
AG01A1DR
Chemical Name:
1-(3-chloroprop-1-yn-1-yl)-4-fluorobenzene
CAS Number:
1179597-72-8
Molecular Formula:
C9H6ClF
Molecular Weight:
168.5953
MDL Number:
MFCD12155700
IUPAC Name:
1-(3-chloroprop-1-ynyl)-4-fluorobenzene
InChI:
InChI=1S/C9H6ClF/c10-7-1-2-8-3-5-9(11)6-4-8/h3-6H,7H2
InChI Key:
IBSVDPJVBSNJLT-UHFFFAOYSA-N
SMILES:
ClCC#Cc1ccc(cc1)F
Properties
Complexity:
169  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
168.014g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
168.595g/mol
Monoisotopic Mass:
168.014g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Properties