Home Other Building Blocks 2,2-DICHLOROHEXANAL

2,2-DICHLOROHEXANAL

CAS No.:
57024-78-9
Catalog Number:
AG00E9EV
Molecular Formula:
C6H10Cl2O
Molecular Weight:
169.0490
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Product Description
Catalog Number:
AG00E9EV
Chemical Name:
2,2-DICHLOROHEXANAL
CAS Number:
57024-78-9
Molecular Formula:
C6H10Cl2O
Molecular Weight:
169.0490
MDL Number:
MFCD01569248
IUPAC Name:
2,2-dichlorohexanal
InChI:
InChI=1S/C6H10Cl2O/c1-2-3-4-6(7,8)5-9/h5H,2-4H2,1H3
InChI Key:
RGTYYGDMHXSGLS-UHFFFAOYSA-N
SMILES:
CCCCC(C=O)(Cl)Cl
Properties
Complexity:
91.1  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
168.011g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
169.045g/mol
Monoisotopic Mass:
168.011g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  
Properties