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Esprocarb

Esprocarb structure

CAS No:
85785-20-2
Formula:
C15H23NOS
Chemical Name:
Esprocarb
Synonyms:
Carbamothioic acid,N-(1,2-dimethylpropyl)-N-ethyl-,S-(phenylmethyl) ester;Carbamothioic acid,(1,2-dimethylpropyl)ethyl-,S-(phenylmethyl) ester;SC 2957;Esprocarb;R 22957;119993-54-3
Categories:
Analytical Chemistry > Standard

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Description

Esprocarb is a member of benzenes and a monothiocarbamic ester.

Esprocarb Basic Attributes

Molecular Weight：

265.41

Exact Mass：

265.41

EC Number：

617-761-5

DSSTox ID：

DTXSID2058201

HScode：

29302000

Characteristics

PSA：

45.6

XLogP3：

4.40620

Density：

1.033g/cm3

Melting Point：

<25 °C

Boiling Point：

135 °C

Flash Point：

170ºC

Refractive Index：

1.534

Water Solubility：

1.85e-05 M

Storage Conditions：

0-6°C

Vapor Pressure：

7.58e-06 mmHg

Safety Information

Transport codes：

UN30829/PG3

wgk germany：

hazard class code：

51/53

safety instructions：

RTECS Number：

FD3830000

Marks：

Precautionary statement(s)：

P261-P273-P311

Hazard Statements：

H331-H411

GHS Classification：

|Danger|H331 (100%): Toxic if inhaled [Danger Acute toxicity, inhalation]|P261, P271, P273, P304+P340, P311, P321, P391, P403+P233, P405, and P501|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.|Warning|H303: May be harmful if swallowed [Warning Acute toxicity, oral]|P201, P202, P260, P281, P308+P313, P312, P314, P405, and P501

Esprocarb Use and Manufacturing

Use Classification：

Agrochemicals -> Herbicides

Computed Properties

Molecular Weight:265.4
XLogP3:4.6
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:6
Exact Mass:265.15003553
Monoisotopic Mass:265.15003553
Topological Polar Surface Area:45.6
Heavy Atom Count:18
Complexity:249
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes