Home Halogens 1,3-Dichloro-2-(prop-2-yn-1-yloxy)benzene

1,3-Dichloro-2-(prop-2-yn-1-yloxy)benzene

CAS No.:
3598-66-1
Catalog Number:
AG003HZW
Molecular Formula:
C9H6Cl2O
Molecular Weight:
201.0493
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Product Description
Catalog Number:
AG003HZW
Chemical Name:
1,3-Dichloro-2-(prop-2-yn-1-yloxy)benzene
CAS Number:
3598-66-1
Molecular Formula:
C9H6Cl2O
Molecular Weight:
201.0493
MDL Number:
MFCD00052717
IUPAC Name:
1,3-dichloro-2-prop-2-ynoxybenzene
InChI:
InChI=1S/C9H6Cl2O/c1-2-6-12-9-7(10)4-3-5-8(9)11/h1,3-5H,6H2
InChI Key:
HCGOBPUSIBTNRV-UHFFFAOYSA-N
SMILES:
C#CCOc1c(Cl)cccc1Cl
Properties
Complexity:
174  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
199.98g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
201.046g/mol
Monoisotopic Mass:
199.98g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3  
Properties