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224779-27-5 | tert-Butyl 5-hydroxy-5,6-dihydropyridine-1(2H)-carboxylate
CAS No: 224779-27-5 Catalog No: AG0037IV MDL No:MFCD04972246
Product Description
Catalog Number:
AG0037IV
Chemical Name:
tert-Butyl 5-hydroxy-5,6-dihydropyridine-1(2H)-carboxylate
CAS Number:
224779-27-5
Molecular Formula:
C10H17NO3
Molecular Weight:
199.2469
MDL Number:
MFCD04972246
IUPAC Name:
tert-butyl 3-hydroxy-3,6-dihydro-2H-pyridine-1-carboxylate
InChI:
InChI=1S/C10H17NO3/c1-10(2,3)14-9(13)11-6-4-5-8(12)7-11/h4-5,8,12H,6-7H2,1-3H3
InChI Key:
NICJOYHYEDFTIX-UHFFFAOYSA-N
SMILES:
OC1C=CCN(C1)C(=O)OC(C)(C)C
Properties
Complexity:
242
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
199.121g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
199.25g/mol
Monoisotopic Mass:
199.121g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
49.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
Literature
| Title | Journal |
|---|---|
| A new route to diverse 1-azasugars from N-Boc-5-hydroxy-3-piperidene as a common building block. | The Journal of organic chemistry 20050624 |
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