tert-Butyl ((1S,3S)-3-aminocyclopentyl)carbamate

Basic Information

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CAS Number

645400-44-8

Molecular Formula

C10H20N2O2

Molecular Weight

200.28 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Amines

Basic Physical Properties

SMILES

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CC(C)(C)OC(=O)NC1CCC(C1)N

InChI

InChI=1S/C10H20N2O2/c1-10(2,3)14-9(13)12-8-5-4-7(11)6-8/h7-8H,4-6,11H2,1-3H3,(H,12,13)/t7-,8-/m0/s1

InChIKey

PGBVMVTUWHCOHX-YUMQZZPRSA-N

LogP

1.3908999999999996

Topological Polar Surface Area

64.35000000000001 Å²

Hydrogen Bond Donor/Acceptor

3 / 4

Complexity

211

Synonyms & References

English

tert-Butyl ((1S,3S)-3-aminocyclopentyl)carbamate
CARBAMIC ACID, [(1S,3S)-3-AMINOCYCLOPENTYL]-, 1,1-DIMETHYLETHYL ESTER (9CI)
tert-butyl (1S,3S)-3-aminocyclopentylcarbamate
tert-butyl N-[(1S,3S)-3-aminocyclopentyl]carbamate
(1S,3S)-3-Amino-1-(Boc-amino)cyclopentane
tert-Butyl (trans-3-aminocyclopentyl)carbamate
tert-butyl [(1S,3S)-3-aminocyclopentyl]carbamate
CARBAMIC ACID, [(1S,3S)-3-AMINOCYCLOPENTYL]-, 1,1-DIMETHYLETHYL ESTER
AK137191
PGBVMV
AKOS022172573
645400-44-8
tert-Butyl [trans-3-aminocyclopentyl]carbamate
tert-butyl n-[(1s,3s)-3-aminocyclopentyl]carbamate
TERT-BUTYL (1S,3S)-3-AMINOCYCLOPENTYLCARBAMATE
XMB73258
A900729
947732-58-3
tert-Butyl N-[trans-3-aminocyclopentyl]carbamate
EN300-7168569
PGBVMVTUWHCOHX-YUMQZZPRSA-N
tert-butyl [(1S,35)-3-aminocyclopentyl]carbamate
Carbamic acid, [(1S,3S)-3-aminocyclopentyl]-, 1,1-dimethylethyl ester (9CI)
(1S,3S)-1-(Boc-Amino)-3-Aminocyclopentane
DS-5808
tert-Butyl((1S,3S)-3-aminocyclopentyl)carbamate
P17298
tert-butyl (1R,3R)-3-aminocyclopentylcarbamate
trans-(3-amino-cyclopentyl)-carbamic acid tert-butyl ester
(1S,3S)- tert-butyl (3-aminocyclopentyl)carbamate
CS-W006944

MDL Number

MFCD11877864

FAQ

What are the physical and chemical properties of tert-Butyl ((1S,3S)-3-aminocyclopentyl)carbamate (CAS: 645400-44-8)?

tert-Butyl ((1S,3S)-3-aminocyclopentyl)carbamate is a white crystalline solid with a molecular weight of approximately 185.26 g/mol. It is slightly soluble in water but soluble in organic solvents like ethanol and acetone. The compound is known for its amine functionality and its ability to react with carbonyl compounds through nucleophilic substitution. It has a pKa of around 8.5, indicating basic properties.

How is tert-Butyl ((1S,3S)-3-aminocyclopentyl)carbamate (CAS: 645400-44-8) typically synthesized?

tert-Butyl ((1S,3S)-3-aminocyclopentyl)carbamate is typically synthesized via a multistep process, starting from cyclopentanone and primary amines. The reaction involves the reduction of cyclopentanone to cyclopentanol, followed by the nucleophilic substitution of the carbonyl group with tert-butyl isocyanate. This process requires mild conditions and can be catalyzed by tertiary amines to improve selectivity and yield.

What industries use tert-Butyl ((1S,3S)-3-aminocyclopentyl)carbamate (CAS: 645400-44-8)?

tert-Butyl ((1S,3S)-3-aminocyclopentyl)carbamate is used in the pharmaceutical industry for the synthesis of drug candidates due to its functional groups. It is also utilized in the polymer industry as a monomer or additive. Additionally, it has applications in the sensor and semiconductor industries for its reactivity and stability.

What precautions should be taken when handling tert-Butyl ((1S,3S)-3-aminocyclopentyl)carbamate (CAS: 645400-44-8)?

Proper handling of tert-Butyl ((1S,3S)-3-aminocyclopentyl)carbamate requires the use of personal protective equipment (PPE) such as gloves, goggles, and a lab coat. It should be stored in a cool, dry place away from direct sunlight and heat sources. In case of spillage, ensure the area is well-ventilated and use appropriate absorbents. Always consult the Safety Data Sheet (SDS) for detailed information on handling and storage.