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2-propan-2-ylsulfanylethynylbenzene

2-propan-2-ylsulfanylethynylbenzene structure

CAS No:
91211-37-9
Formula:
C11H12S
Chemical Name:
2-propan-2-ylsulfanylethynylbenzene
Synonyms:
91211-37-9;isopropyl (2-phenylethynyl) sulfide;2-propan-2-ylsulfanylethynylbenzene;NSC72469;SCHEMBL13478278;DTXSID50919890;ZINC1698539;NSC-72469;{[(Propan-2-yl)sulfanyl]ethynyl}benzene

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2-propan-2-ylsulfanylethynylbenzene Basic Attributes

Molecular Weight：

176.28 g/mol

Exact Mass：

176.06597156 g/mol

NSC Number：

72469

Characteristics

PSA：

25.3 Å²

Computed Properties

Molecular Weight:176.28
XLogP3:3.8
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:3
Exact Mass:176.06597156
Monoisotopic Mass:176.06597156
Topological Polar Surface Area:25.3
Heavy Atom Count:12
Complexity:176
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-propan-2-ylsulfanylethynylbenzene

Basic Attributes
Characteristics
Computed Properties

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