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3446-89-7 | 4-(Methylthio);benzaldehyde
CAS No: 3446-89-7 Catalog No: AG003LS6 MDL No:MFCD00006948
Product Description
Catalog Number:
AG003LS6
Chemical Name:
4-(Methylthio);benzaldehyde
CAS Number:
3446-89-7
Molecular Formula:
C8H8OS
Molecular Weight:
152.2135
MDL Number:
MFCD00006948
IUPAC Name:
4-methylsulfanylbenzaldehyde
InChI:
InChI=1S/C8H8OS/c1-10-8-4-2-7(6-9)3-5-8/h2-6H,1H3
InChI Key:
QRVYABWJVXXOTN-UHFFFAOYSA-N
SMILES:
CSc1ccc(cc1)C=O
EC Number:
222-365-7
UNII:
1TVQ11BIY8
Properties
Complexity:
106
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
152.03g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
152.211g/mol
Monoisotopic Mass:
152.03g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
42.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
Literature
| Title | Journal |
|---|---|
| 4-Methyl-1-[4-(methyl-sulfan-yl)benzyl-idene]thio-semicarbazide. | Acta crystallographica. Section E, Structure reports online 20110801 |
| (E)-N'-[4-(Methyl-sulfan-yl)benzyl-idene]furan-2-carbohydrazide monohydrate. | Acta crystallographica. Section E, Structure reports online 20100801 |
| 4-Ethyl-1-[4-(methyl-sulfan-yl)benzyl-idene]thio-semicarbazide. | Acta crystallographica. Section E, Structure reports online 20100701 |
| (E)-5-(3,5-Dimethyl-phen-yl)-N-[4-(methyl-sulfan-yl)benzyl-idene]-1,3,4-thia-diazol-2-amine. | Acta crystallographica. Section E, Structure reports online 20100201 |
| 4-[4-(Methyl-sulfan-yl)phen-yl]-6-phenyl-2,2'-bipyridine. | Acta crystallographica. Section E, Structure reports online 20080101 |
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
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