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Home > Aldehydes > 749263-56-7
749263-56-7 | Benzaldehyde, 2-chloro-4-[[4-(phenylmethoxy)phenyl]thio]-
CAS No: 749263-56-7 Catalog No: AG005G8G MDL No:
Product Description
Catalog Number:
AG005G8G
Chemical Name:
Benzaldehyde, 2-chloro-4-[[4-(phenylmethoxy)phenyl]thio]-
CAS Number:
749263-56-7
Molecular Formula:
C20H15ClO2S
Molecular Weight:
354.8499
IUPAC Name:
2-chloro-4-(4-phenylmethoxyphenyl)sulfanylbenzaldehyde
InChI:
InChI=1S/C20H15ClO2S/c21-20-12-19(9-6-16(20)13-22)24-18-10-7-17(8-11-18)23-14-15-4-2-1-3-5-15/h1-13H,14H2
InChI Key:
FLOLMKDWOIRRQA-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(cc1Cl)Sc1ccc(cc1)OCc1ccccc1
Properties
Complexity:
378
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
354.048g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
354.848g/mol
Monoisotopic Mass:
354.048g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
51.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.5
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