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24852-71-9 | 2-(benzylsulfanyl)benzaldehyde
CAS No: 24852-71-9 Catalog No: AG01A4YW MDL No:MFCD07365229
Product Description
Catalog Number:
AG01A4YW
Chemical Name:
2-(benzylsulfanyl)benzaldehyde
CAS Number:
24852-71-9
Molecular Formula:
C14H12OS
Molecular Weight:
228.3095
MDL Number:
MFCD07365229
IUPAC Name:
2-benzylsulfanylbenzaldehyde
InChI:
InChI=1S/C14H12OS/c15-10-13-8-4-5-9-14(13)16-11-12-6-2-1-3-7-12/h1-10H,11H2
InChI Key:
SWVKTJBDZNJLDT-UHFFFAOYSA-N
SMILES:
O=Cc1ccccc1SCc1ccccc1
Properties
Complexity:
211
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
228.061g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
228.309g/mol
Monoisotopic Mass:
228.061g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
42.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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