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1-Ethyl octanedioate

1-Ethyl octanedioate structure

1-Ethyl octanedioate 

structure
  • CAS No:

    14113-01-0

  • Formula:

    C10H18O4

  • Chemical Name:

    1-Ethyl octanedioate

  • Synonyms:

    Octanedioic acid,1-ethyl ester;Suberic acid,monoethyl ester;Octanedioic acid,monoethyl ester;Suberic acid,ethyl ester;1-Ethyl octanedioate;Monoethyl suberate;Ethyl hydrogen suberate

1-Ethyl octanedioate Basic Attributes

202.25

202.25

1775737

237-968-0

2918990090

Characteristics

63.6

1.97470

0.9807 g/cm3 @ Temp: 20 °C

25 °C

192 °C @ Press: 17 Torr

111.7ºC

1.451

Safety Information

36/38

26-36

P264, P280, P302+P352, P305+P351+P338, P321, P332+P313, P337+P313, P362

H315

|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P264, P280, P302+P352, P305+P351+P338, P321, P332+P313, P337+P313, and P362|Aggregated GHS information provided by 4 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

1-Ethyl octanedioate Use and Manufacturing

Octanedioic acid, ethyl-: INACTIVE

Computed Properties

Molecular Weight:202.25
XLogP3:1.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:9
Exact Mass:202.12050905
Monoisotopic Mass:202.12050905
Topological Polar Surface Area:63.6
Heavy Atom Count:14
Complexity:177
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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