(S)-1-Boc-2-(aminomethyl)pyrrolidine - CAS 119020-01-8
Catalog: |
BB004367 |
Product Name: |
(S)-1-Boc-2-(aminomethyl)pyrrolidine |
CAS: |
119020-01-8 |
Synonyms: |
(2S)-2-(aminomethyl)-1-pyrrolidinecarboxylic acid tert-butyl ester; tert-butyl (2S)-2-(aminomethyl)pyrrolidine-1-carboxylate |
IUPAC Name: | tert-butyl (2S)-2-(aminomethyl)pyrrolidine-1-carboxylate |
Description: | (S)-1-Boc-2-(aminomethyl)pyrrolidine (CAS# 119020-01-8) is a useful research chemical. |
Molecular Weight: | 200.28 |
Molecular Formula: | C10H20N2O2 |
Canonical SMILES: | CC(C)(C)OC(=O)N1CCCC1CN |
InChI: | InChI=1S/C10H20N2O2/c1-10(2,3)14-9(13)12-6-4-5-8(12)7-11/h8H,4-7,11H2,1-3H3/t8-/m0/s1 |
InChI Key: | SOGXYCNKQQJEED-QMMMGPOBSA-N |
Boiling Point: | 280.3 °C at 760 mmHg |
Density: | 1.044 g/cm3 |
Solubility: | Miscible with N-methylpyrrolidinone. |
Appearance: | Yellowish liquid |
MDL: | MFCD03419257 |
LogP: | 1.98280 |
GHS Hazard Statement: | H302 (88.64%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P260, P264, P270, P280, P301+P312, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P321, P330, P363, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
WO-2021150792-A1 | Novel compounds and composition for targeted therapy of kidney-associated cancers | 20200121 |
WO-2020247445-A1 | Imidazolo derivatives, compositions and methods as orexin antagonists | 20190604 |
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WO-2020117974-A1 | Compounds and compositions for eye treatments | 20181204 |
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Complexity: | 211 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 1 |
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: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 200.152477885 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 55.6 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.7 |
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Amines and Anilines
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