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Cyclohexanecarboxaldehyde

Cyclohexanecarboxaldehyde structure

CAS No:
2043-61-0
Formula:
C7H12O
Chemical Name:
Cyclohexanecarboxaldehyde
Synonyms:
Cyclohexanecarboxaldehyde;Cyclohexanealdehyde;Cyclohexylformaldehyde;Cyclohexanal;Formylcyclohexane;Cyclohexanaldehyde;Cyclohexylcarboxaldehyde;1-Formylcyclohexane;Cyclohexanecarbaldehyde;1-Cyclohexanecarboxaldehyde;Hexahydrobenzaldehyde;Cyclohexylcarbaldehyde;Cyclohexane-1-aldehyde;NSC 68509;Cyclohexancarboxaldehyde;1610718-03-0
Categories:
Chemical Reagents > Organic Reagents

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Description

Clear colorless to faintly pink liquid

Cyclohexanecarboxaldehyde Basic Attributes

Molecular Weight：

112.17

Exact Mass：

112.17

BRN：

878306

EC Number：

218-057-7

UNII：

SW0X317TE3

NSC Number：

68509

DSSTox ID：

DTXSID40174375

HScode：

2912299000

Characteristics

PSA：

17.1

XLogP3：

1.8

Appearance：

Clear colorless to faintly pink Liquid

Density：

0.9235 g/cm³ @ Temp: 25 °C

Melting Point：

104-107 °C @ Solvent: Ethyl acetate, Hexane

Boiling Point：

159.3 °C

Flash Point：

105 °F

Refractive Index：

1.449-1.452

Water Solubility：

soluble in chloroform, ether, alcohol. Slightly soluble in water.

Storage Conditions：

2-8°C

Vapor Pressure：

2.5mmHg at 25°C

Safety Information

Packing level：

Ⅲ

Hazard category：

Transport codes：

UN 1989 3/PG 3

wgk germany：

hazard class code：

10-36/37/38-36

safety instructions：

16-26-36-37/39

Marks：

Xi,F

Stability/Shelf Life：

Stable at room temperature in closed containers under normal storage and handling conditions.

Precautionary statement(s)：

P261-P305 + P351 + P338

Hazard Statements：

H226-H315-H319-H335

GHS Classification：

|Warning|H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]|P210, P233, P240, P241, P242, P243, P261, P264, P271, P280, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P370+P378, P403+P233, P403+P235, P405, and P501|Aggregated GHS information provided by 70 companies from 7 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Drug Information

MeSH Entry Terms：

cyclohexanaecarboxaldehyde

Cyclohexanecarboxaldehyde Use and Manufacturing

Methods of Manufacturing

The preparation method is to use cyclohexene to carry out hydroformylation in the presence of Ru-Co catalyst to obtain the product.

Uses

It is used in the reaction of alkyd catalyzed by nano magnesium oxide and ethyl azide acetate to produce α-diazo-β-hydroxyesters (α-diazo-β-hydroxyesters). It is used in medicine to synthesize Melagatran/Fosinopril Fosinopril, etc. to treat hypertension.

Computed Properties

Molecular Weight:112.17
XLogP3:1.8
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:1
Exact Mass:112.088815002
Monoisotopic Mass:112.088815002
Topological Polar Surface Area:17.1
Heavy Atom Count:8
Complexity:72.5
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of Cyclohexanecarboxaldehyde

Description
Basic Attributes
Characteristics
Safety Information
Drug Information
Use and Manufacturing
Computed Properties
Recommended Suppliers
Latest News
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Cyclohexanecarboxaldehyde

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