3-(Methylthio)-1,2-propanediol
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3-(Methylthio)-1,2-propanediol
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CAS No:
22551-26-4
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Formula:
C4H10O2S
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Chemical Name:
3-(Methylthio)-1,2-propanediol
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Synonyms:
1,2-Propanediol,3-(methylthio)-;3-(Methylthio)-1,2-propanediol;98923-12-7
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CAS No:
Characteristics
65.76000
-0.29740
Clear colorless liquid
1.175g/cm3
261.4ºC
127.6ºC
n20/D 1.516(lit.)
0.00166mmHg at 25°C
Computed Properties
Molecular Weight:122.19
XLogP3:-0.4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:122.04015073
Monoisotopic Mass:122.04015073
Topological Polar Surface Area:65.8
Heavy Atom Count:7
Complexity:40.7
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
Guide of 3-(Methylthio)-1,2-propanediol
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