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Home > Aldehydes > 1249739-74-9
1249739-74-9 | 2-[(2,5-DICHLOROPHENYL)SULFANYL]ACETALDEHYDE
CAS No: 1249739-74-9 Catalog No: AG01BIU8 MDL No:MFCD16096693
Product Description
Catalog Number:
AG01BIU8
Chemical Name:
2-[(2,5-DICHLOROPHENYL)SULFANYL]ACETALDEHYDE
CAS Number:
1249739-74-9
Molecular Formula:
C8H6Cl2OS
Molecular Weight:
221.1036
MDL Number:
MFCD16096693
IUPAC Name:
2-(2,5-dichlorophenyl)sulfanylacetaldehyde
InChI:
InChI=1S/C8H6Cl2OS/c9-6-1-2-7(10)8(5-6)12-4-3-11/h1-3,5H,4H2
InChI Key:
HIKBMSSCUYCXKO-UHFFFAOYSA-N
SMILES:
Clc1ccc(cc1SCC=O)Cl
Properties
Complexity:
154
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
219.952g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
221.095g/mol
Monoisotopic Mass:
219.952g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
42.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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