((1R,3R)-3-Amino-cyclopentyl)-carbamic Acid tert-Butyl Ester - CAS 1009075-44-8
Catalog:
BB074488
Product Name:
((1R,3R)-3-Amino-cyclopentyl)-carbamic Acid tert-Butyl Ester
CAS:
1009075-44-8
Synonyms:
tert-Butyl ((1R,3R)-3-aminocyclopentyl)carbamate; tert-butyl n-[(1r,3r)-3-aminocyclopentyl]carbamate; tert-Butyl rac-[(1R,3R)-3-aminocyclopentyl] carbamate; tert-Butyl ((1R,3R)-rel-3-aminocyclopentyl)carbamate; tert-Butyl N-[trans-3-aminocyclopentyl]carbamate; tert-Butyl [trans-3-aminocyclopentyl]carbamate
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BB074488
1 g
$1180
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BB074488
5 g
$3980
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IUPAC Name: tert-butyl N-[(1R,3R)-3-aminocyclopentyl]carbamate
Description: ((1R,3R)-3-Amino-cyclopentyl)-carbamic Acid tert-Butyl Ester is used in the preparation of quinoline-3-carboxoamides as H-PGDS inhibitors as well as novel triazolo-pyrrolopyridines as Janus kinase 1 inhibitors.
Molecular Weight: 200.28
Molecular Formula: C10H20N2O2
Canonical SMILES: 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-/m1/s1
InChI Key: PGBVMVTUWHCOHX-HTQZYQBOSA-N
References: Cadilla, R.; et al. PCT Int. Appl. 482pp.Patent 2017 CODEN:PIXXD2; Hurley, C.; et al. Bioorganic Med. Chem. Lett, 23, 3592 (2013).
GHS Hazard Statement: H312 (100%): Harmful in contact with skin [Warning Acute toxicity, dermal]
Precautionary Statement: P264+P265, P280, P302+P352, P305+P351+P338, P317, P321, P337+P317, P362+P364, and P501
Signal Word: Warning
Complexity: 211
Compound Is Canonicalized: Yes
Covalently-Bonded Unit Count: 1
Defined Atom Stereocenter Count: 2
Defined Bond Stereocenter Count: 0
Exact Mass: 200.152477885
Formal Charge: 0
Heavy Atom Count: 14
Hydrogen Bond Acceptor Count: 3
Hydrogen Bond Donor Count: 2
Isotope Atom Count: 0
Monoisotopic Mass: 200.152477885
Rotatable Bond Count: 3
Topological Polar Surface Area: 64.4Ų
Undefined Atom Stereocenter Count: 0
Undefined Bond Stereocenter Count: 0
XLogP3: 1
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