Home Halogens 3-(5-chlorothiophen-2-yl)-2-methylprop-2-enal

3-(5-chlorothiophen-2-yl)-2-methylprop-2-enal

CAS No.:
1563958-97-3
Catalog Number:
AG01C05H
Molecular Formula:
C8H7ClOS
Molecular Weight:
186.6586
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Product Description
Catalog Number:
AG01C05H
Chemical Name:
3-(5-chlorothiophen-2-yl)-2-methylprop-2-enal
CAS Number:
1563958-97-3
Molecular Formula:
C8H7ClOS
Molecular Weight:
186.6586
MDL Number:
MFCD21851906
IUPAC Name:
3-(5-chlorothiophen-2-yl)-2-methylprop-2-enal
InChI:
InChI=1S/C8H7ClOS/c1-6(5-10)4-7-2-3-8(9)11-7/h2-5H,1H3
InChI Key:
MCSWRTRQJKPWDP-UHFFFAOYSA-N
SMILES:
CC(=Cc1ccc(s1)Cl)C=O
Properties
Complexity:
179  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
185.991g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
186.653g/mol
Monoisotopic Mass:
185.991g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
45.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1  
XLogP3:
2.9  
Properties