(R)-tert-butyl 1-aminopropan-2-ylcarbamate - CAS 100927-10-4
Catalog: |
BB000389 |
Product Name: |
(R)-tert-butyl 1-aminopropan-2-ylcarbamate |
CAS: |
100927-10-4 |
Synonyms: |
N-[(2R)-1-aminopropan-2-yl]carbamic acid tert-butyl ester; tert-butyl N-[(2R)-1-aminopropan-2-yl]carbamate |
IUPAC Name: | tert-butyl N-[(2R)-1-aminopropan-2-yl]carbamate |
Description: | (R)-tert-butyl 1-aminopropan-2-ylcarbamate (CAS# 100927-10-4) is used as an intermediate in the preparation of potent benzothiophene inhibitors of mitogen activated protein kinase-activated protein kinase 2 (MK2). |
Molecular Weight: | 174.24 |
Molecular Formula: | C8H18N2O2 |
Canonical SMILES: | CC(CN)NC(=O)OC(C)(C)C |
InChI: | InChI=1S/C8H18N2O2/c1-6(5-9)10-7(11)12-8(2,3)4/h6H,5,9H2,1-4H3,(H,10,11)/t6-/m1/s1 |
InChI Key: | JQXZBJAAOLPTKP-ZCFIWIBFSA-N |
Boiling Point: | 299.8 °C at 760 mmHg |
Appearance: | Solid |
Storage: | Store at 2-8 °C |
MDL: | MFCD11109482 |
LogP: | 2.75150 |
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 |
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Complexity: | 152 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 1 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 174.136827821 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 174.136827821 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 64.4 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.4 |
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Amines and Anilines
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