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DL-MALIC ACID DI-N-BUTYL ESTER

DL-MALIC ACID DI-N-BUTYL ESTER structure

CAS No:
6280-99-5
Formula:
C12H22O5
Chemical Name:
DL-MALIC ACID DI-N-BUTYL ESTER
Synonyms:
Butanedioic acid, hydroxy-, dibutyl ester, (±;Butanedioic acid, hydroxy-, dibutyl ester, (.+/-.)-;dibutyl(+-)-hydroxybutanedioate;dibutylester,(+-)-malicaci;dl-dibutylmalate;ENT-337;hydroxy-,dibutylester,(+-)-butanedioicaci;Butanedioic acid,2-hydroxy-, 1,4-dibutyl ester

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Description

Dibutyl malate is a 3-hydroxy carboxylic acid.

DL-MALIC ACID DI-N-BUTYL ESTER Basic Attributes

Molecular Weight：

246.3

Exact Mass：

246.30

EC Number：

228-485-6

NSC Number：

261107|6194

TSCA：

TSCA listed

Color/Form：

Colorless to Light yellow to Light orange

HScode：

2917.19.7050

Characteristics

PSA：

72.83000

XLogP3：

1.42400

Density：

1.04

Boiling Point：

299°C (estimate)

Refractive Index：

1.4390 to 1.4420

Water Solubility：

2270 mg/L @ 25 °C (est)

PKA：

12.14±0.20(Predicted)

Safety Information

wgk germany：

WGK 3

hazard class code：

36/37/38

safety instructions：

26-36/37/39

Precautionary statement(s)：

P264, P280, P305+P351+P338, P33, P313

Hazard Statements：

36/37/38

GHS Classification：

|Warning|H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]|P264, P280, P305+P351+P338, and P337+P313|Aggregated GHS information provided by 22 companies from 1 notifications to the ECHA C&L Inventory.

DL-MALIC ACID DI-N-BUTYL ESTER Use and Manufacturing

Uses

1,4-Dibutyl 2-Hydroxybutanedioate is used in preparation of α-carboxy-ω-hydroxy polyoxyalkylenes.

Manufacturing Info：

Butanedioic acid, 2-hydroxy-, 1,4-dibutyl ester: ACTIVE

Use Classification：

Food additives -> Flavoring Agents

Food Additive Classes：

Flavoring Agents

Computed Properties

Molecular Weight:246.30
XLogP3:1.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:11
Exact Mass:246.14672380
Monoisotopic Mass:246.14672380
Topological Polar Surface Area:72.8
Heavy Atom Count:17
Complexity:227
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of DL-MALIC ACID DI-N-BUTYL ESTER

Description
Basic Attributes
Characteristics
Safety Information
Use and Manufacturing
Computed Properties
Learn More Other Chemicals

DL-MALIC ACID DI-N-BUTYL ESTER

SDS

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