Home Halogens 2,4-dichloro-3-ethynyl-1,5-dimethoxybenzene

2,4-dichloro-3-ethynyl-1,5-dimethoxybenzene

CAS No.:
1453211-48-7
Catalog Number:
AG01DKFN
Molecular Formula:
C10H8Cl2O2
Molecular Weight:
231.0753
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Product Description
Catalog Number:
AG01DKFN
Chemical Name:
2,4-dichloro-3-ethynyl-1,5-dimethoxybenzene
CAS Number:
1453211-48-7
Molecular Formula:
C10H8Cl2O2
Molecular Weight:
231.0753
MDL Number:
MFCD28129863
IUPAC Name:
2,4-dichloro-3-ethynyl-1,5-dimethoxybenzene
InChI:
InChI=1S/C10H8Cl2O2/c1-4-6-9(11)7(13-2)5-8(14-3)10(6)12/h1,5H,2-3H3
InChI Key:
ZGXDEQGKNWQYAD-UHFFFAOYSA-N
SMILES:
COc1cc(OC)c(c(c1Cl)C#C)Cl
Properties
Complexity:
220  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.99g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
231.072g/mol
Monoisotopic Mass:
229.99g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4  
Properties