Home Halogens methyl 3-(3,5-dichlorophenyl)prop-2-ynoate

methyl 3-(3,5-dichlorophenyl)prop-2-ynoate

CAS No.:
1344359-12-1
Catalog Number:
AG01B1D2
Molecular Formula:
C10H6Cl2O2
Molecular Weight:
229.0594
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Product Description
Catalog Number:
AG01B1D2
Chemical Name:
methyl 3-(3,5-dichlorophenyl)prop-2-ynoate
CAS Number:
1344359-12-1
Molecular Formula:
C10H6Cl2O2
Molecular Weight:
229.0594
MDL Number:
MFCD20347304
IUPAC Name:
methyl 3-(3,5-dichlorophenyl)prop-2-ynoate
InChI:
InChI=1S/C10H6Cl2O2/c1-14-10(13)3-2-7-4-8(11)6-9(12)5-7/h4-6H,1H3
InChI Key:
MUATVVRPLPDPII-UHFFFAOYSA-N
SMILES:
COC(=O)C#Cc1cc(Cl)cc(c1)Cl
Properties
Complexity:
266  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
227.974g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
229.056g/mol
Monoisotopic Mass:
227.974g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6  
Properties