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2-(Methylsulfonyl)-1-phenylethanone

2-(Methylsulfonyl)-1-phenylethanone structure

CAS No:
3708-04-1
Formula:
C9H10O3S
Chemical Name:
2-(Methylsulfonyl)-1-phenylethanone
Synonyms:
Ethanone,2-(methylsulfonyl)-1-phenyl-;Acetophenone,2-(methylsulfonyl)-;2-(Methylsulfonyl)-1-phenylethanone;(Methylsulfonyl)benzoylmethane;2-(Methylsulfonyl)acetophenone;Methyl phenacyl sulfone;α-(Methylsulfonyl)acetophenone;NSC 137561;NSC 2736;NSC 51601;2-(Methylsulfonyl)-1-phenylethan-1-one;2-Methanesulfonyl-1-phenylethan-1-one

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2-(Methylsulfonyl)-1-phenylethanone Basic Attributes

Molecular Weight：

198.23900

Exact Mass：

198.24

NSC Number：

137561|51601|2736

DSSTox ID：

DTXSID80190574

HScode：

2914700090

Characteristics

PSA：

59.59000

XLogP3：

1.99470

Density：

1.25g/cm3

Melting Point：

110 °C

Boiling Point：

407ºC at 760mmHg

Flash Point：

263.7ºC

Refractive Index：

1.537

Safety Information

Precautionary statement(s)：

P264, P270, P280, P301+P312, P305+P351+P338, P310, P330, P501

Hazard Statements：

H302

GHS Classification：

|Danger|H302 (97.44%): Harmful if swallowed [Warning Acute toxicity, oral]|P264, P270, P280, P301+P312, P305+P351+P338, P310, P330, and P501|Aggregated GHS information provided by 39 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:198.24
XLogP3:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:198.03506535
Monoisotopic Mass:198.03506535
Topological Polar Surface Area:59.6
Heavy Atom Count:13
Complexity:268
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Hot Searches: tricalcium phosphate; copper sulphide; tert butanol; ambroxol; bromide formula; t-butyl alcohol

Guide of 2-(Methylsulfonyl)-1-phenylethanone

Basic Attributes
Characteristics
Safety Information
Computed Properties

2-(Methylsulfonyl)-1-phenylethanone

SDS

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