2-amino-N-cyclohexyl-N-methylbenzene-1-sulfonamide

Basic Information

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CAS Number

70693-59-3

Molecular Formula

C13H20N2O2S

Molecular Weight

268.38 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Amines

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

Melting Point

98-101 °C

Boiling Point

428.1°C at 760 mmHg

Density

1.24

Flash Point

212.7 ºC

Refractive Index

1.593

SMILES

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CN(C1CCCCC1)S(=O)(=O)C2=CC=CC=C2N

InChI

InChI=1S/C13H20N2O2S/c1-15(11-7-3-2-4-8-11)18(16,17)13-10-6-5-9-12(13)14/h5-6,9-11H,2-4,7-8,14H2,1H3

InChIKey

IPEHSCPRVOWQFQ-UHFFFAOYSA-N

LogP

2.222

Topological Polar Surface Area

63.400000000000006 Å²

Hydrogen Bond Donor/Acceptor

2 / 4

Complexity

358

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

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

Synonyms & References

English

EN300-20816
EINECS 274-775-0
MFCD02093750
AMY21807
Z104483038
NS00037090
2-Amino-N-Cyclohexyl-N-Methyl-Benzenesulfonamide
DTXSID1044982
Tox21_301697
CAS-70693-59-3
A836964
Q27294838
70693-59-3
CHEMBL3188952
DTXCID9024982
AKOS000120820
o-Aminobenzene sulfon-N-methyl cyclohexylamide
Benzenesulfonamide, 2-amino-N-cyclohexyl-N-methyl-
UNII-Z0I9A1O0OD
IPEHSCPRVOWQFQ-UHFFFAOYSA-N
2-(Cyclohexylmethylsulfamoyl)aniline
2-Amino-N-cyclohexyl-N-methylbenzenesulfonamide
NCGC00256293-01
2-Amino-N-cyclohexyl-N-methylbenzenesulfonamide, 97%
VCA69359
Z0I9A1O0OD
SCHEMBL1143286
FT-0641310
2-Amino-N-cyclohexyl-N-methylbenzene sulfonamide
2-amino-N-cyclohexyl-N-methylbenzene-1-sulfonamide
AS-67562

MDL Number

MFCD02093750

Customs Code

2935009090

FAQ

What are the physical and chemical properties of 2-amino-N-cyclohexyl-N-methylbenzene-1-sulfonamide (CAS: 70693-59-3)?

2-Amino-N-cyclohexyl-N-methylbenzene-1-sulfonamide (CAS: 70693-59-3) is a white to light yellow crystalline solid with a molecular weight of approximately 349.4 g/mol. It has a high solubility in water and organic solvents. The compound is known for its low reactivity due to the presence of the amino group, which can participate in hydrogen bonding and form complexes. It is stable under normal conditions but should be stored away from strong acids and bases.

How is 2-amino-N-cyclohexyl-N-methylbenzene-1-sulfonamide (CAS: 70693-59-3) typically synthesized?

2-Amino-N-cyclohexyl-N-methylbenzene-1-sulfonamide (CAS: 70693-59-3) can be synthesized by the condensation of N-methyl-N-cyclohexyl-2-benzamidoacetamide with 1-hydroxy-2-naphthoic acid in the presence of a base such as sodium hydroxide. The reaction involves the formation of an amide bond and a sulfonamide linkage. The yield is typically around 85%, and the selectivity is high due to the specific reactivity of the amino and sulfonamido groups.

What industries use 2-amino-N-cyclohexyl-N-methylbenzene-1-sulfonamide (CAS: 70693-59-3)?

2-Amino-N-cyclohexyl-N-methylbenzene-1-sulfonamide (CAS: 70693-59-3) is primarily used in the pharmaceutical and chemical industries. It serves as a key intermediate in the synthesis of various drugs, particularly those targeting cardiovascular and neurological diseases. The compound is also used in the production of dyes and pigments for the textile and polymer industries due to its color and stability.

What precautions should be taken when handling 2-amino-N-cyclohexyl-N-methylbenzene-1-sulfonamide (CAS: 70693-59-3)?

When handling 2-amino-N-cyclohexyl-N-methylbenzene-1-sulfonamide (CAS: 70693-59-3), it is important to wear appropriate personal protective equipment (PPE) such as gloves, goggles, and a lab coat. The compound should be handled in a well-ventilated area or fume hood to prevent inhalation. Spills should be cleaned up immediately using appropriate absorbents and properly disposed of according to local regulations. Always refer to the Safety Data Sheet (SDS) for detailed handling and disposal instructions.