2,4-Dimethyl-6-methylsulfanyl-benzaldehyde

HCID 22320862
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Basic information

Standard SMILES
CSc1cc(C)cc(C)c1C=O
InChIKey
XFRBRGSUJZUPQT-UHFFFAOYSA-N
Molecular formula
C10H12OS
Average molar mass
180.27 g/mol

Names & identifiers

Preferred name
2,4-Dimethyl-6-methylsulfanyl-benzaldehyde
IUPAC
2,4-dimethyl-6-methylsulfanylbenzaldehyde

Names & synonyms

SCHEMBL5100486XFRBRGSUJZUPQT-UHFFFAOYSA-N2,4-dimethyl-6-methylsulfanyl-benzaldehyde

Database identifiers

PubChem CID
22320862

Properties

Computed structural properties

XLogP
2.6
Topological polar surface area
42.4 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
2
Heavy atoms
12

Related reactions

2 records
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Compound notes

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