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Home > Encyclopedia > Benzoic acid, 2-(isocyanatosulfonyl)-, ethyl ester

Benzoic acid, 2-(isocyanatosulfonyl)-, ethyl ester

Benzoic acid, 2-(isocyanatosulfonyl)-, ethyl ester structure

Benzoic acid, 2-(isocyanatosulfonyl)-, ethyl ester 

structure
  • CAS No:

    77375-79-2

  • Formula:

    C10H9NO5S

  • Chemical Name:

    Benzoic acid, 2-(isocyanatosulfonyl)-, ethyl ester

  • Synonyms:

    Benzoic acid,2-(isocyanatosulfonyl)-,ethyl ester;Ethyl 2-(isocyanatosulfonyl)benzoate;2-Ethoxycarbonylbenzosulfonyl isocyanate;2-(Isocyanatosulfonyl)benzoic acid ethyl ester

Description

Liquid


Liquid

Benzoic acid, 2-(isocyanatosulfonyl)-, ethyl ester Basic Attributes

255.244

255.25

410-220-2

Characteristics

98.2

2.5

1.34±0.1 g/cm3(Predicted)

Safety Information

2-14-22-41-42/43-48/22

8-23-26-30-35-36/37/39

E,Xn

P260, P261, P264, P270, P272, P280, P285, P301+P312, P302+P352, P304+P341, P305+P351+P338, P310, P314, P321, P330, P333+P313, P342+P311, P363, P501

H302

|Danger|H302: Harmful if swallowed [Warning Acute toxicity, oral]|P260, P261, P264, P270, P272, P280, P285, P301+P312, P302+P352, P304+P341, P305+P351+P338, P310, P314, P321, P330, P333+P313, P342+P311, P363, and P501|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P260, P261, P264, P270, P271, P272, P280, P285, P301+P312, P302+P352, P304+P340, P304+P341, P305+P351+P338, P310, P312, P314, P321, P330, P332+P313, P333+P313, P342+P311, P362, P363, P403+P233, P405, and P501|Aggregated GHS information provided by 13 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Benzoic acid, 2-(isocyanatosulfonyl)-, ethyl ester Use and Manufacturing

Uses

Intermediates


Agricultural products (non-pesticidal)

Pesticide, fertilizer, and other agricultural chemical manufacturing|Benzoic acid, 2-(isocyanatosulfonyl)-, ethyl ester: ACTIVE|PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.

Computed Properties

Molecular Weight:255.25
XLogP3:2.5
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:5
Exact Mass:255.02014356
Monoisotopic Mass:255.02014356
Topological Polar Surface Area:98.2
Heavy Atom Count:17
Complexity:419
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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