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144032-16-6 | Propanal, 2-(2,6-dichlorophenoxy)-, (S)- (9CI)
CAS No: 144032-16-6 Catalog No: AG001ITO MDL No:
Product Description
Catalog Number:
AG001ITO
Chemical Name:
Propanal, 2-(2,6-dichlorophenoxy)-, (S)- (9CI)
CAS Number:
144032-16-6
Molecular Formula:
C9H8Cl2O2
Molecular Weight:
219.0646
IUPAC Name:
2-(2,6-dichlorophenoxy)propanal
InChI:
InChI=1S/C9H8Cl2O2/c1-6(5-12)13-9-7(10)3-2-4-8(9)11/h2-6H,1H3
InChI Key:
VYWDLCNCKWJZJF-UHFFFAOYSA-N
SMILES:
O=C[C@@H](Oc1c(Cl)cccc1Cl)C
Properties
Complexity:
165
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
217.99g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
219.061g/mol
Monoisotopic Mass:
217.99g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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