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3-[(2-Hydroxyethyl)thio]butanal 2,2-dimethylhydrazone

HCID 165345895
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Basic information

CAS
887141-26-6
Standard SMILES
CC(CC=NN(C)C)SCCO
InChIKey
UTLVRTOOEMULIB-UHFFFAOYSA-N
Molecular formula
C8H18N2OS
Average molar mass
190.31 g/mol
Monoisotopic mass
190.11398438

Names & identifiers

Preferred name
3-[(2-Hydroxyethyl)thio]butanal 2,2-dimethylhydrazone
IUPAC
2-[4-(dimethylhydrazinylidene)butan-2-ylsulfanyl]ethanol

Names & synonyms

DTXSID1012161883-[(2-Hydroxyethyl)thio]butanal 2,2-dimethylhydrazone2-{[4-(Dimethylhydrazinylidene)butan-2-yl]sulfanyl}ethan-1-ol887141-26-6

Database identifiers

CAS
887141-26-6
PubChem CID
165345895
DTXSID
DTXSID101216188

Properties

Computed structural properties

XLogP
0.8
Topological polar surface area
61.1 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
6
Heavy atoms
12
Formal charge
0
Complexity
128

Related reactions

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Compound notes

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