methyl 3-(3-methoxy-3-oxopropyl)sulfanylpropanoate

CAS: 4131-74-2

Molecular Formula	`C8H14O4S`
Molecular Weight	206.26 g/mol
LogP	0.5
Topological Polar Surface Area	77.9 A2
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	5
Rotatable Bonds	8
Exact Mass	206.06128
Heavy Atoms	13
Complexity	152.0

Chemical Identifiers

CAS Number	4131-74-2
SMILES	`COC(=O)CCSCCC(=O)OC`
InChIKey	`MYWWWNVEZBAKHR-UHFFFAOYSA-N`

📖 Product Overview

methyl 3-(3-methoxy-3-oxopropyl)sulfanylpropanoate (CAS: 4131-74-2) is a chemical compound with molecular formula C8H14O4S and molecular weight 206.26 g/mol. Its IUPAC systematic name is methyl 3-(3-methoxy-3-oxopropyl)sulfanylpropanoate. LogP 0.5 Topological Polar Surface Area 77.9 A2 Hydrogen Bond Donors 0 Hydrogen Bond Acceptors 5 Rotatable Bonds 8 Exact Mass 206.06128 Heavy Atoms 13 Complexity 152.0 InChI Key: MYWWWNVEZBAKHR-UHFFFAOYSA-N. SMILES: COC(=O)CCSCCC(=O)OC.

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