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Hexanedioic acid, 3-oxo-, 1,6-diethyl ester

Hexanedioic acid, 3-oxo-, 1,6-diethyl ester structure

CAS No:
7149-59-9
Formula:
C10H16O5
Chemical Name:
Hexanedioic acid, 3-oxo-, 1,6-diethyl ester
Synonyms:
Hexanedioic acid,3-oxo-,1,6-diethyl ester;Hexanedioic acid,3-oxo-,diethyl ester;Diethyl β-oxoadipate;3-Oxohexanedioic acid diethyl ester;Diethyl 3-oxohexanedioate;3-Oxoadipic acid diethyl ester;Diethyl 4-oxohexanedioate;NSC 72263;1,6-Diethyl 3-oxohexanedioate

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Hexanedioic acid, 3-oxo-, 1,6-diethyl ester Basic Attributes

Molecular Weight：

216.23100

Exact Mass：

216.23

EC Number：

230-479-3

NSC Number：

72263

DSSTox ID：

DTXSID40221712

HScode：

2918300090

Characteristics

PSA：

69.67000

XLogP3：

0.85200

Density：

1.093g/cm3

Boiling Point：

65-70 °C @ Press: 1 x 10^-3 Torr

Flash Point：

123.9ºC

Refractive Index：

1.438

Safety Information

wgk germany：

hazard class code：

R36/37/38

safety instructions：

26-36

Marks：

Precautionary statement(s)：

P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, P501

Hazard Statements：

H315

GHS Classification：

|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, 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.

Computed Properties

Molecular Weight:216.23
XLogP3:0.5
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:9
Exact Mass:216.09977361
Monoisotopic Mass:216.09977361
Topological Polar Surface Area:69.7
Heavy Atom Count:15
Complexity:234
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of Hexanedioic acid, 3-oxo-, 1,6-diethyl ester

Basic Attributes
Characteristics
Safety Information
Computed Properties
Learn More Other Chemicals

Hexanedioic acid, 3-oxo-, 1,6-diethyl ester

SDS

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