(S)-2-(Boc-amino)-1-pentanol - CAS 116611-55-3
Catalog: |
BB003775 |
Product Name: |
(S)-2-(Boc-amino)-1-pentanol |
CAS: |
116611-55-3 |
Synonyms: |
N-[(2S)-1-hydroxypentan-2-yl]carbamic acid tert-butyl ester; tert-butyl N-[(2S)-1-hydroxypentan-2-yl]carbamate |
IUPAC Name: | tert-butyl N-[(2S)-1-hydroxypentan-2-yl]carbamate |
Description: | (S)-2-(Boc-amino)-1-pentanol (CAS# 116611-55-3 ) is a useful research chemical. |
Molecular Weight: | 203.28 |
Molecular Formula: | C10H21NO3 |
Canonical SMILES: | CCCC(CO)NC(=O)OC(C)(C)C |
InChI: | InChI=1S/C10H21NO3/c1-5-6-8(7-12)11-9(13)14-10(2,3)4/h8,12H,5-7H2,1-4H3,(H,11,13)/t8-/m0/s1 |
InChI Key: | GCBVZHIDLDHLOF-QMMMGPOBSA-N |
LogP: | 2.06300 |
Publication Number | Title | Priority Date |
US-2020299283-A1 | Compounds and methods of use | 20190227 |
AU-2009256645-A1 | Pyrazine derivatives as epithelial sodium channel blockers | 20080610 |
CA-2727196-A1 | Organic compounds | 20080610 |
EP-2300010-A2 | Organic compounds | 20080610 |
EP-2300010-B1 | Pyrazine derivatives as epithelial sodium channel blockers | 20080610 |
Complexity: | 175 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 1 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 203.15214353 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 203.15214353 |
Rotatable Bond Count: | 6 |
Topological Polar Surface Area: | 58.6 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.6 |
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