Methyl 3-(Boc-amino)bicyclo[1.1.1]pentane-1-carboxylate - CAS 676371-64-5
Catalog: |
BB033355 |
Product Name: |
Methyl 3-(Boc-amino)bicyclo[1.1.1]pentane-1-carboxylate |
CAS: |
676371-64-5 |
Synonyms: |
3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-bicyclo[1.1.1]pentanecarboxylic acid methyl ester; methyl 3-[(2-methylpropan-2-yl)oxycarbonylamino]bicyclo[1.1.1]pentane-1-carboxylate |
IUPAC Name: | methyl 3-[(2-methylpropan-2-yl)oxycarbonylamino]bicyclo[1.1.1]pentane-1-carboxylate |
Description: | Methyl 3-(Boc-amino)bicyclo[1.1.1]pentane-1-carboxylate (CAS# 676371-64-5) is a useful research chemical. |
Molecular Weight: | 241.28 |
Molecular Formula: | C12H19NO4 |
Canonical SMILES: | CC(C)(C)OC(=O)NC12CC(C1)(C2)C(=O)OC |
InChI: | InChI=1S/C12H19NO4/c1-10(2,3)17-9(15)13-12-5-11(6-12,7-12)8(14)16-4/h5-7H2,1-4H3,(H,13,15) |
InChI Key: | KDOXMPLTEPMVQD-UHFFFAOYSA-N |
MDL: | MFCD24476148 |
LogP: | 1.99770 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation] |
Precautionary Statement: | P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
WO-2021127303-A1 | Progranulin modulators and methods of using the same | 20191220 |
WO-2020069027-A1 | Treatment of hematological malignancies with inhibitors of menin | 20180926 |
WO-2019243822-A1 | 1,2,4-triazole derivatives as tankyrase inhibitors | 20180619 |
CN-112469714-A | 1,2, 4-triazole derivatives as tankyrase inhibitors | 20180619 |
EP-3810597-A1 | 1,2,4-triazole derivatives as tankyrase inhibitors | 20180619 |
Complexity: | 349 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 241.13140809 |
Formal Charge: | 0 |
Heavy Atom Count: | 17 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 241.13140809 |
Rotatable Bond Count: | 5 |
Topological Polar Surface Area: | 64.6 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.1 |
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