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prop-2-ynylsulfonylbenzene

prop-2-ynylsulfonylbenzene structure

CAS No:
2525-40-8
Formula:
C9H8O2S
Chemical Name:
prop-2-ynylsulfonylbenzene
Synonyms:
Phenyl propargyl sulfone;prop-2-ynylsulfonylbenzene;NSC46018;Propargylphenyl sulfone;phenyl prop-2-ynyl sulfone;SCHEMBL1482097;(2-propyn-1-ylsulfonyl)benzene;CTK4F5315;DTXSID20179904;Benzene,(2-propyn-1-ylsulfonyl)-

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prop-2-ynylsulfonylbenzene Basic Attributes

Molecular Weight：

180.221

Exact Mass：

180.025

NSC Number：

46018

DSSTox ID：

DTXSID20179904

Characteristics

PSA：

42.5

XLogP3：

1.3

Density：

1.217±0.06 g/cm3(Predicted)

Melting Point：

93 °C

Computed Properties

Molecular Weight:180.23
XLogP3:1.3
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:180.02450067
Monoisotopic Mass:180.02450067
Topological Polar Surface Area:42.5
Heavy Atom Count:12
Complexity:269
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of prop-2-ynylsulfonylbenzene

Basic Attributes
Characteristics
Computed Properties

prop-2-ynylsulfonylbenzene

SDS

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