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Ethyl 2-cyano-3-methylpentanoate

Ethyl 2-cyano-3-methylpentanoate structure

CAS No:
7309-45-7
Formula:
C9H15NO2
Chemical Name:
Ethyl 2-cyano-3-methylpentanoate
Synonyms:
Pentanoic acid,2-cyano-3-methyl-,ethyl ester;Valeric acid,2-cyano-3-methyl-,ethyl ester;Ethyl 2-cyano-3-methylpentanoate;NSC 124618;NSC 79190;2-Cyano-3-methyl-valeric acid ethyl ester;2-Cyano-3-Methyl-Pentanoic Acid Ethyl Ester

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Ethyl 2-cyano-3-methylpentanoate Basic Attributes

Molecular Weight：

169.22 g/mol

Exact Mass：

169.22

EC Number：

230-765-8

NSC Number：

124618|79190

Characteristics

PSA：

50.1 Å²

Density：

0.9089 g/cm³ @ Temp: 86.9 °C

Boiling Point：

98 °C @ Press: 6 Torr

Safety Information

GHS Classification：

|Danger|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P310, P312, P321, P332+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:169.22
XLogP3:2.3
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:5
Exact Mass:169.110278721
Monoisotopic Mass:169.110278721
Topological Polar Surface Area:50.1
Heavy Atom Count:12
Complexity:192
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of Ethyl 2-cyano-3-methylpentanoate

Basic Attributes
Characteristics
Safety Information
Computed Properties
Learn More Other Chemicals

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