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3,3-dimethyl-1-(1-methyltetrazol-5-yl)sulfanylbutan-2-one

3,3-dimethyl-1-(1-methyltetrazol-5-yl)sulfanylbutan-2-one structure

CAS No:
380170-76-3
Formula:
C8H14N4OS
Chemical Name:
3,3-dimethyl-1-(1-methyltetrazol-5-yl)sulfanylbutan-2-one
Synonyms:
MLS000679753;CHEMBL1445616;SCHEMBL14605923;HMS2767L20;ZINC3217344;STK522261;AKOS003337712;MCULE-9447749996;SMR000296991;SR-01000030621;SR-01000030621-1;Z18520242;3,3-dimethyl-1-[(1-methyl-1H-tetrazol-5-yl)thio]-2-butanone;3,3-dimethyl-1-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]butan-2-one;3,3-dimethyl-1-[(1-methyl-1H-1,2,3,4-tetrazol-5-yl)sulfanyl]butan-2-one;380170-76-3

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3,3-dimethyl-1-(1-methyltetrazol-5-yl)sulfanylbutan-2-one Basic Attributes

Molecular Weight：

214.29 g/mol

Exact Mass：

214.08883226 g/mol

Characteristics

PSA：

86 Å²

Water Solubility：

16.6 [ug/mL]

Computed Properties

Molecular Weight:214.29
XLogP3:1.3
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:214.08883226
Monoisotopic Mass:214.08883226
Topological Polar Surface Area:86
Heavy Atom Count:14
Complexity:216
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3,3-dimethyl-1-(1-methyltetrazol-5-yl)sulfanylbutan-2-one

Basic Attributes
Characteristics
Computed Properties

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