(2,3-Dihydro-1H-indol-6-yl)-carbamic Acid Tert-butyl Ester - CAS 885270-09-7
Catalog: |
BB066437 |
Product Name: |
(2,3-Dihydro-1H-indol-6-yl)-carbamic Acid Tert-butyl Ester |
CAS: |
885270-09-7 |
Synonyms: |
1,1-Dimethylethyl N-(2,3-dihydro-1H-indol-6-yl)carbamate |
IUPAC Name: | tert-butyl N-(2,3-dihydro-1H-indol-6-yl)carbamate |
Description: | (2,3-Dihydro-1H-Indol-6-yl)-Carbamic Acid Tert-Butyl Ester is a useful research chemical for organic synthesis and other chemical processes. |
Molecular Weight: | 234.29 |
Molecular Formula: | C13H18N2O2 |
Canonical SMILES: | CC(C)(C)OC(=O)NC1=CC2=C(CCN2)C=C1 |
InChI: | InChI=1S/C13H18N2O2/c1-13(2,3)17-12(16)15-10-5-4-9-6-7-14-11(9)8-10/h4-5,8,14H,6-7H2,1-3H3,(H,15,16) |
InChI Key: | VWVPSFNYFXGUHV-UHFFFAOYSA-N |
References: | Bogdan, A. R., et al: Org. Lett., 18, 1732 (2016). |
Complexity: | 286 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 234.136827821 |
Formal Charge: | 0 |
Heavy Atom Count: | 17 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 234.136827821 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 50.4Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.7 |
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