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4-(benzenesulfinyl)butan-2-one

4-(benzenesulfinyl)butan-2-one structure

CAS No:
77657-95-5
Formula:
C10H12O2S
Chemical Name:
4-(benzenesulfinyl)butan-2-one
Synonyms:
77657-95-5;4-(benzenesulfinyl)butan-2-one;4-(phenylsulfinyl)butan-2-one;NSC45651;SCHEMBL6916923;DTXSID70286415;NSC-45651;AKOS013964005

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4-(benzenesulfinyl)butan-2-one Basic Attributes

Molecular Weight：

196.27 g/mol

Exact Mass：

196.05580079 g/mol

NSC Number：

45651

DSSTox ID：

DTXSID70286415

Characteristics

PSA：

53.4 Å²

Computed Properties

Molecular Weight:196.27
XLogP3:0.6
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:196.05580079
Monoisotopic Mass:196.05580079
Topological Polar Surface Area:53.4
Heavy Atom Count:13
Complexity:195
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-(benzenesulfinyl)butan-2-one

Basic Attributes
Characteristics
Computed Properties

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