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3-Chloro-α-[(4-methylphenyl)sulfonyl]-2-quinoxalineacetonitrile

3-Chloro-α-[(4-methylphenyl)sulfonyl]-2-quinoxalineacetonitrile structure

CAS No:
121512-59-2
Formula:
C17H12ClN3O2S
Chemical Name:
3-Chloro-α-[(4-methylphenyl)sulfonyl]-2-quinoxalineacetonitrile
Synonyms:
2-Quinoxalineacetonitrile,3-chloro-α-[(4-methylphenyl)sulfonyl]-;3-Chloro-α-[(4-methylphenyl)sulfonyl]-2-quinoxalineacetonitrile;(3-Chloro-quinoxalin-2-yl)-(toluene-4-sulfonyl)-acetonitrile;2-(3-Chloroquinoxalin-2-yl)-2-(4-methylphenyl)sulfonylacetonitrile;2-(3-Chloroquinoxalin-2-yl)-2-(4-methylbenzenesulfonyl)acetonitrile;1323508-09-3

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3-Chloro-α-[(4-methylphenyl)sulfonyl]-2-quinoxalineacetonitrile Basic Attributes

Molecular Weight：

357.812

Exact Mass：

357.81

DSSTox ID：

DTXSID30391690

Characteristics

PSA：

92.1

XLogP3：

4.71098

Density：

1.423g/cm3

Melting Point：

247 °C

Boiling Point：

562ºC at 760mmHg

Flash Point：

293.7ºC

Refractive Index：

1.653

Computed Properties

Molecular Weight:357.8
XLogP3:3.3
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:357.0338755
Monoisotopic Mass:357.0338755
Topological Polar Surface Area:92.1
Heavy Atom Count:24
Complexity:589
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3-Chloro-α-[(4-methylphenyl)sulfonyl]-2-quinoxalineacetonitrile

Basic Attributes
Characteristics
Computed Properties

3-Chloro-α-[(4-methylphenyl)sulfonyl]-2-quinoxalineacetonitrile

SDS

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