6-(Boc-amino)-3-azabicyclo[3.1.0]hexane - CAS 198211-38-0
Catalog: |
BB015324 |
Product Name: |
6-(Boc-amino)-3-azabicyclo[3.1.0]hexane |
CAS: |
198211-38-0 |
Synonyms: |
N-(3-azabicyclo[3.1.0]hexan-6-yl)carbamic acid tert-butyl ester; tert-butyl N-(3-azabicyclo[3.1.0]hexan-6-yl)carbamate |
IUPAC Name: | tert-butyl N-(3-azabicyclo[3.1.0]hexan-6-yl)carbamate |
Description: | 6-(Boc-amino)-3-azabicyclo[3.1.0]hexane (CAS# 198211-38-0 ) is a useful research chemical. |
Molecular Weight: | 198.26 |
Molecular Formula: | C10H18N2O2 |
Canonical SMILES: | CC(C)(C)OC(=O)NC1C2C1CNC2 |
InChI: | InChI=1S/C10H18N2O2/c1-10(2,3)14-9(13)12-8-6-4-11-5-7(6)8/h6-8,11H,4-5H2,1-3H3,(H,12,13) |
InChI Key: | QIYOMZXJQAKHEK-UHFFFAOYSA-N |
MDL: | MFCD10698578 |
LogP: | 1.44860 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P310, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
WO-2021066088-A1 | Novel triazine derivative | 20191002 |
WO-2020248972-A1 | Heterocyclic compounds as kinase inhibitors, compositions comprising the heterocyclic compound, and methods of use thereof | 20190610 |
WO-2020150372-A1 | Antimicrobial compounds and methods | 20190116 |
US-2019367515-A1 | Autotaxin inhibitors and uses thereof | 20180529 |
WO-2019228403-A1 | Autotaxin inhibitors and uses thereof | 20180529 |
Complexity: | 237 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 198.136827821 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 198.136827821 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 50.4 Å2 |
Undefined Atom Stereocenter Count: | 2 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.6 |
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Amines and Anilines
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