5-Amino-2-Boc-octahydrocyclopenta[c]pyrrole - CAS 1031335-28-0
Catalog: |
BB001022 |
Product Name: |
5-Amino-2-Boc-octahydrocyclopenta[c]pyrrole |
CAS: |
1031335-28-0 |
Synonyms: |
5-amino-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrole-2-carboxylic acid tert-butyl ester; tert-butyl 5-amino-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrole-2-carboxylate |
IUPAC Name: | tert-butyl 5-amino-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrole-2-carboxylate |
Description: | 5-Amino-2-Boc-octahydrocyclopenta[c]pyrrole (CAS# 1031335-28-0) is a useful research chemical. |
Molecular Weight: | 226.32 |
Molecular Formula: | C12H22N2O2 |
Canonical SMILES: | CC(C)(C)OC(=O)N1CC2CC(CC2C1)N |
InChI: | InChI=1S/C12H22N2O2/c1-12(2,3)16-11(15)14-6-8-4-10(13)5-9(8)7-14/h8-10H,4-7,13H2,1-3H3 |
InChI Key: | DPYIUHWPQGIBSS-UHFFFAOYSA-N |
LogP: | 2.22880 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P310, P312, P321, P332+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
CN-110950842-A | Quinoline derivatives having indoleamine-2, 3-dioxygenase inhibitory activity | 20180927 |
EP-3858813-A1 | Quinolone derivative having indoleamine-2,3-dioxygenase inhibited activity | 20180927 |
KR-20210066857-A | Quinoline derivatives having indoleamine-2,3-dioxygenase inhibitory activity | 20180927 |
WO-2020043271-A1 | Novel pyrrolidinyl amide compounds for the treatment of autoimmune disease | 20180828 |
EP-3844159-A1 | Novel pyrrolidinyl amide compounds for the treatment of autoimmune disease | 20180828 |
Complexity: | 271 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 226.168127949 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 226.168127949 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 55.6 Å2 |
Undefined Atom Stereocenter Count: | 2 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1 |
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