Home Halogens 1-chloro-2-(3-chloroprop-1-yn-1-yl)benzene

1-chloro-2-(3-chloroprop-1-yn-1-yl)benzene

CAS No.:
1179176-22-7
Catalog Number:
AG01A1R2
Molecular Formula:
C9H6Cl2
Molecular Weight:
185.0499
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Product Description
Catalog Number:
AG01A1R2
Chemical Name:
1-chloro-2-(3-chloroprop-1-yn-1-yl)benzene
CAS Number:
1179176-22-7
Molecular Formula:
C9H6Cl2
Molecular Weight:
185.0499
MDL Number:
MFCD12824549
IUPAC Name:
1-chloro-2-(3-chloroprop-1-ynyl)benzene
InChI:
InChI=1S/C9H6Cl2/c10-7-3-5-8-4-1-2-6-9(8)11/h1-2,4,6H,7H2
InChI Key:
VYOPEAVPTIVEDT-UHFFFAOYSA-N
SMILES:
ClCC#Cc1ccccc1Cl
Properties
Complexity:
175  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
183.985g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
185.047g/mol
Monoisotopic Mass:
183.985g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3  
Properties