Home Halogens 3-Buten-2-one, 4-(3,4-dichlorophenyl)-, (3E)-

3-Buten-2-one, 4-(3,4-dichlorophenyl)-, (3E)-

CAS No.:
55420-70-7
Catalog Number:
AG01BGBA
Molecular Formula:
C10H8Cl2O
Molecular Weight:
215.0759
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Product Description
Catalog Number:
AG01BGBA
Chemical Name:
3-Buten-2-one, 4-(3,4-dichlorophenyl)-, (3E)-
CAS Number:
55420-70-7
Molecular Formula:
C10H8Cl2O
Molecular Weight:
215.0759
MDL Number:
MFCD00052849
IUPAC Name:
(E)-4-(3,4-dichlorophenyl)but-3-en-2-one
InChI:
InChI=1S/C10H8Cl2O/c1-7(13)2-3-8-4-5-9(11)10(12)6-8/h2-6H,1H3/b3-2+
InChI Key:
HSKXQSBYMAGOIH-NSCUHMNNSA-N
SMILES:
CC(=O)C=Cc1ccc(c(c1)Cl)Cl
NSC Number:
298203
Properties
Complexity:
213  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1  
Exact Mass:
213.995g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
215.073g/mol
Monoisotopic Mass:
213.995g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3  
Properties