L-Lysine lactam - CAS 21568-87-6
Catalog: |
BB016968 |
Product Name: |
L-Lysine lactam |
CAS: |
21568-87-6 |
Synonyms: |
(s)-3-aminoazepan-2-one; (s)-alpha-amino-omega-caprolactam; (s)-3-amino-hexahydro-2-azepinone; L-2-aminohexano-6-lactam; L-2-Amino-cycloheptalactam; L-(-)-α-Amino-ε-caprolactam |
IUPAC Name: | (3S)-3-aminoazepan-2-one |
Description: | L-lysine lactam has been used in the synthesis of lysine sulfonamide HIV protease inhibitors, as well as bengamide derivatives with in vitro anticancer activity. |
Molecular Weight: | 128.17 |
Molecular Formula: | C6H12N2O |
Canonical SMILES: | C1CCNC(=O)C(C1)N |
InChI: | InChI=1S/C6H12N2O/c7-5-3-1-2-4-8-6(5)9/h5H,1-4,7H2,(H,8,9)/t5-/m0/s1 |
InChI Key: | BOWUOGIPSRVRSJ-YFKPBYRVSA-N |
Boiling Point: | 315.1±35.0 °C at 760 mmHg |
Melting Point: | 97-101 °C |
Density: | 1.0±0.1 g/cm3 |
Appearance: | Pale-yellow to yellow-brown sticky oil |
LogP: | 0.64290 |
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, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
US-2020317689-A1 | Bridged tricyclic carbamoylpyridone compounds and their pharmaceutical use | 20190322 |
WO-2020197991-A1 | Bridged tricyclic carbamoylpyridone compounds and their pharmaceutical use | 20190322 |
US-11084832-B2 | Bridged tricyclic carbamoylpyridone compounds and their pharmaceutical use | 20190322 |
TW-202003524-A | Thienopyrimidinone compounds | 20180330 |
US-10584133-B2 | Thienopyrimidinone compounds | 20180330 |
Complexity: | 114 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 1 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 128.094963011 |
Formal Charge: | 0 |
Heavy Atom Count: | 9 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 128.094963011 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 55.1 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -0.5 |
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