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Phorate sulfone

Phorate sulfone structure

CAS No:
2588-04-7
Formula:
C7H17O4PS3
Chemical Name:
Phorate sulfone
Synonyms:
Phosphorodithioic acid,O,O-diethyl S-[(ethylsulfonyl)methyl] ester;Phosphorodithioic acid,O,O-diethyl (ethylsulfonyl)methyl ester;Methanethiol,(ethylsulfonyl)-,S-ester with O,O-diethyl phosphorodithioate;O,O-Diethyl S-ethylsulfonylmethyl phosphorodithioate;O,O-Diethyl S-ethylsulfonylmethyl thionophosphate;Phorate sulfone
Categories:
Chemical Reagents > Organic Reagents

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Phorate sulfone Basic Attributes

Molecular Weight：

292.38

Exact Mass：

292.38

EC Number：

203-777-6

UNII：

R20VQB36US

DSSTox ID：

DTXSID6042282

HScode：

2931900090

Characteristics

PSA：

128.18000

XLogP3：

4.14070

Density：

1.306g/cm3

Boiling Point：

150 °C @ Press: 0.1 Torr

Flash Point：

-26 °C

Refractive Index：

1.524

Water Solubility：

859.3mg/L(19 ºC)

Storage Conditions：

2-8°C

Safety Information

Packing level：

Hazard category：

6.1(a)

Transport codes：

3018

hazard class code：

28-67-65-62-51/53-48/20-38-11

safety instructions：

28-36/37-45-62-61-33-29-16-9

RTECS Number：

TD9100000

Marks：

T+,N,Xn,F

Precautionary statement(s)：

P301 + P310 + P330

Hazard Statements：

H300

GHS Classification：

|Danger|H300 (100%): Fatal if swallowed [Danger Acute toxicity, oral]|P264, P270, P301+P310, P321, P330, P405, and P501|Aggregated GHS information provided by 41 companies from 2 notifications to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:292.4
XLogP3:3.7
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:8
Exact Mass:292.00265954
Monoisotopic Mass:292.00265954
Topological Polar Surface Area:118
Heavy Atom Count:15
Complexity:299
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes