tert-Butyl cyclohex-3-en-1-ylcarbamate

Basic Information

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CAS Number

135262-85-0

Molecular Formula

C11H19NO2

Molecular Weight

197.28 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ethers

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

SMILES

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CC(C)(C)OC(=O)NC1CCC=CC1

InChI

InChI=1S/C11H19NO2/c1-11(2,3)14-10(13)12-9-7-5-4-6-8-9/h4-5,9H,6-8H2,1-3H3,(H,12,13)

InChIKey

IRBIWNJTHWLIMD-UHFFFAOYSA-N

LogP

2.6198000000000006

Topological Polar Surface Area

38.33 Å²

Hydrogen Bond Donor/Acceptor

1 / 3

Complexity

228

Synonyms & References

English

tert-Butyl cyclohex-3-en-1-ylcarbamate
4-(Boc-amino)cyclohexene
tert-butyl cyclohex-3-enylcarbamate
tert-butyl N-cyclohex-3-en-1-ylcarbamate
3-cyclohexen-1-ylcarbamic acid tert-butyl ester
Boc-4-amino cyclohexene
Carbamic acid,3-cyclohexen-1-yl-,1,1-dimethylethyl ester
N-Boc-cyclohex-3-enamine
tert-Butyl 3-cyclohexen-1-ylcarbamate
Cyclohex-3-enyl-carbamic acid tert-butyl ester
tert-butyl N-(cyclohex-3-en-1-yl)carbamate
cyclohex-3-enyl-carbamic acid tert-butyl ester
SY257826
MFCD11975573
IRBIWNJTHWLIMD-UHFFFAOYSA-N
SY020496
BS-25615
DTXSID60453836
MFCD24466589
Carbamic acid, 3-cyclohexen-1-yl-, 1,1-dimethylethyl ester (9CI)
EN300-3079243
A887704
AKOS013788831
(R)-4-(Boc-amino)cyclohexene
SB32974
1350636-87-1
4-(tert-Butoxycarbonylamino)-1-cyclohexene
CS-0341024
135262-85-0
SCHEMBL508784
tert-Butylcyclohex-3-en-1-ylcarbamate

MDL Number

MFCD11975573

Customs Code

2924299090

FAQ

What are the physical and chemical properties of tert-Butyl cyclohex-3-en-1-ylcarbamate (CAS: 135262-85-0)?

tert-Butyl cyclohex-3-en-1-ylcarbamate is a colorless to yellowish oil with a molecular weight of approximately 216.36 g/mol. It has a high boiling point (around 260°C) and a low solubility in water (less than 0.1 g/L). This compound is known for its stability but can react with strong bases to form the corresponding amine. It is also susceptible to hydrolysis under basic conditions.

How is tert-Butyl cyclohex-3-en-1-ylcarbamate (CAS: 135262-85-0) typically synthesized?

tert-Butyl cyclohex-3-en-1-ylcarbamate is typically synthesized via the condensation of 1-tert-butoxycarbonyl-3-cyclohexene with N-methylmorpholine N-oxide (NMO) in the presence of a catalytic amount of 4-(dimethylamino)pyridine (DMAP). This reaction provides excellent selectivity and yield, making it a common method for its production.

What industries use tert-Butyl cyclohex-3-en-1-ylcarbamate (CAS: 135262-85-0)?

tert-Butyl cyclohex-3-en-1-ylcarbamate is used in various industries, particularly in pharmaceuticals for intermediate synthesis, and in polymer science for the modification of polymer properties. It also finds applications in the production of sensors and semiconductors, where its chemical reactivity and stability are valuable.

What precautions should be taken when handling tert-Butyl cyclohex-3-en-1-ylcarbamate (CAS: 135262-85-0)?

When handling tert-Butyl cyclohex-3-en-1-ylcarbamate, it is essential to wear appropriate personal protective equipment (PPE) such as gloves, goggles, and a lab coat. This compound should be handled in a well-ventilated area or a fume hood to minimize exposure. In case of spills, use appropriate absorbent materials and follow the safety data sheet (SDS) guidelines for proper disposal. Ensure that the work area is well-ventilated and that all safety protocols are strictly followed.