Home Other Building Blocks 1,3-difluoro-5-(prop-2-yn-1-yloxy)benzene

1,3-difluoro-5-(prop-2-yn-1-yloxy)benzene

CAS No.:
457628-50-1
Catalog Number:
AG01B7I8
Molecular Formula:
C9H6F2O
Molecular Weight:
168.1401
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Product Description
Catalog Number:
AG01B7I8
Chemical Name:
1,3-difluoro-5-(prop-2-yn-1-yloxy)benzene
CAS Number:
457628-50-1
Molecular Formula:
C9H6F2O
Molecular Weight:
168.1401
MDL Number:
MFCD17216189
IUPAC Name:
1,3-difluoro-5-prop-2-ynoxybenzene
InChI:
InChI=1S/C9H6F2O/c1-2-3-12-9-5-7(10)4-8(11)6-9/h1,4-6H,3H2
InChI Key:
ZOFTWFDLBJRYJI-UHFFFAOYSA-N
SMILES:
C#CCOc1cc(F)cc(c1)F
Properties
Complexity:
174  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
168.039g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
168.143g/mol
Monoisotopic Mass:
168.039g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties