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16369-05-4 | 1-Butanol, 2-amino-3-methyl-
CAS No: 16369-05-4 Catalog No: AG001UBE MDL No:MFCD00004730
Product Description
Catalog Number:
AG001UBE
Chemical Name:
1-Butanol, 2-amino-3-methyl-
CAS Number:
16369-05-4
Molecular Formula:
C5H13NO
Molecular Weight:
103.1628
MDL Number:
MFCD00004730
IUPAC Name:
2-amino-3-methylbutan-1-ol
InChI:
InChI=1S/C5H13NO/c1-4(2)5(6)3-7/h4-5,7H,3,6H2,1-2H3
InChI Key:
NWYYWIJOWOLJNR-UHFFFAOYSA-N
SMILES:
OCC(C(C)C)N
NSC Number:
322922
Properties
Complexity:
45.3
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
103.1g/mol
Formal Charge:
0
Heavy Atom Count:
7
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
103.165g/mol
Monoisotopic Mass:
103.1g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
46.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0
Literature
| Title | Journal |
|---|---|
| Synthesis, conformational stability, and asymmetric transformation of atropisomeric 1,8-bisphenolnaphthalenes. | The Journal of organic chemistry 20110520 |
| Palladacycles of novel bisoxazoline chelating ligands based on the dimeric cyclobutadiene linked cobalt sandwich compound [(η5-Cp)Co(η4-C4Ph3)]2. | Dalton transactions (Cambridge, England : 2003) 20110514 |
| Synthesis of highly enantioenriched chiral alpha-aminoorganotins via diastereoselective ring opening of chiral N-(arenesulfonyl) 2-tributylstannyloxazolidines. | The Journal of organic chemistry 20090821 |
| Highly enantioselective borane reduction of heteroaryl and heterocyclic ketoxime ethers catalyzed by novel spiroborate ester derived from diphenylvalinol: application to the synthesis of nicotine analogues. | The Journal of organic chemistry 20080606 |
| Enantioseparation of phenylglycinol in chiral-modified zeolite HY: a molecular simulation study. | Chirality 20070601 |
| Invariom-model refinement of L-valinol. | Acta crystallographica. Section C, Crystal structure communications 20061101 |
| Chiral bis(amino alcohol)oxalamide gelators-gelation properties and supramolecular organization: racemate versus pure enantiomer gelation. | Chemistry (Weinheim an der Bergstrasse, Germany) 20031121 |
| A long-range chiral relay via tertiary amide group in asymmetric catalysis: new amino acid-derived N,P-ligands for copper-catalysed conjugate addition. | Chemical communications (Cambridge, England) 20030807 |
| Dietary low-dose sucrose modulation of IQ-induced genotoxicity in the colon and liver of Big Blue rats. | Mutation research 20030619 |
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