3-Aminocyclohexanol

Basic Information

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CAS Number

6850-39-1

Molecular Formula

C6H13NO

Molecular Weight

115.18 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Amines

Basic Physical Properties

Physical State

Yellow to Brown Sticky Oil to Solid

Melting Point

64-69°C

Boiling Point

201.1°C at 760 mmHg

SMILES

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C1CC(CC(C1)O)N

InChI

InChI=1S/C6H13NO/c7-5-2-1-3-6(8)4-5/h5-6,8H,1-4,7H2

InChIKey

NIQIPYGXPZUDDP-UHFFFAOYSA-N

LogP

0.24859999999999977

Topological Polar Surface Area

46.25 Å²

Hydrogen Bond Donor/Acceptor

3 / 2

Complexity

74.9

Safety Information

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Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H332 Harmful if inhaled
Acute toxicity, inhalation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Synonyms & References

English

3-Amino-cyclohexanol
40525-77-7
cis-3-Amino-cyclohexanol
FT-0696332
SB23131
SY157928
SB30678
SCHEMBL63214
AKOS016842295
SB38373
(3-Hydroxycyclohexyl)amine
3-hydroxycyclohexyl amine
3-aminocyclohexanol, AldrichCPR
FT-0689650
FT-0651426
NoName_3027
Ziprasidone Amino Acid Sodium Salt
3-aminocyclohexan-1-ol
6850-39-1
A25706
F2147-2237
AC-1188
AM20070553
FT-0602020
1798033-44-9
SY002564
MFCD03790923
3-aminocyclohexanol
GS-4399
FT-0696334
SB30677

MDL Number

MFCD03790923

Customs Code

2922199090

FAQ

What are the physical and chemical properties of 3-Aminocyclohexanol (CAS: 6850-39-1)?

3-Aminocyclohexanol (CAS: 6850-39-1) is a colorless to light yellow liquid with a molecular weight of approximately 111.15 g/mol. It is slightly soluble in water but miscible with common organic solvents. The compound has a basic pH and is known for its reactivity with carboxylic acids to form amides. It is also prone to hydrolysis under basic conditions.

How is 3-Aminocyclohexanol (CAS: 6850-39-1) typically synthesized?

3-Aminocyclohexanol (CAS: 6850-39-1) is usually synthesized via reduction of 3-cyclohexanol using sodium borohydride or lithium aluminum hydride. Alternative methods include the hydrogenation of 3-hydroxycyclohexanone or the transamination of cyclohexanone using ammonia. These processes yield high selectivity and good yields.

What industries use 3-Aminocyclohexanol (CAS: 6850-39-1)?

3-Aminocyclohexanol (CAS: 6850-39-1) is widely used in the pharmaceutical industry for the synthesis of drugs, particularly those requiring amino functionalities. It is also utilized in the polymer industry for the production of polyurethane and other resins. Additionally, it finds applications in the production of sensors and semiconductors due to its reactivity and chemical properties.

What precautions should be taken when handling 3-Aminocyclohexanol (CAS: 6850-39-1)?

When handling 3-Aminocyclohexanol (CAS: 6850-39-1), it is essential to wear appropriate personal protective equipment (PPE), including gloves, safety goggles, and a lab coat. It should be stored in a cool, dry place away from direct sunlight and heat sources. Fume hoods should be used during operations involving this compound. In case of a spill, immediately clean up using appropriate absorbents and follow the Material Safety Data Sheet (MSDS) guidelines for proper disposal.