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2-Acetyl-5-methylhexanoicacidethylester

2-Acetyl-5-methylhexanoicacidethylester structure

CAS No:
1522-30-1
Formula:
C11H20O3
Chemical Name:
2-Acetyl-5-methylhexanoicacidethylester
Synonyms:
ethyl 2-acetyl-5-methylhexanoate;Hexanoic acid, 2-acetyl-5-methyl-, ethyl ester;NSC174099;SCHEMBL4142966;DTXSID50306105;ALBB-021837;AKOS005266781;MCULE-6353554935;NSC-174099;DA-44143

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2-Acetyl-5-methylhexanoicacidethylester Basic Attributes

Molecular Weight：

200.28

Exact Mass：

200.141

NSC Number：

174099

DSSTox ID：

DTXSID50306105

HScode：

2918300090

Characteristics

PSA：

43.4

XLogP3：

2.6

Density：

0.947g/cm3

Boiling Point：

235.1ºC at 760 mmHg

Flash Point：

92.5ºC

Refractive Index：

1.43

Vapor Pressure：

0.051mmHg at 25°C

Computed Properties

Molecular Weight:200.27
XLogP3:2.6
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:7
Exact Mass:200.14124450
Monoisotopic Mass:200.14124450
Topological Polar Surface Area:43.4
Heavy Atom Count:14
Complexity:197
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Hot Searches: iron nitrate; molybdenum disulfide; tert butanol; difluoroethane; indosin; melting point range acetanilide

Guide of 2-Acetyl-5-methylhexanoicacidethylester

Basic Attributes
Characteristics
Computed Properties

2-Acetyl-5-methylhexanoicacidethylester

SDS

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