(R,S)-3-Boc-amino-9-boc-1,2,3,4-tetrahydro-carbazole-3-carboxylic Acid - CAS 1031927-09-9
Catalog: |
BB072511 |
Product Name: |
(R,S)-3-Boc-amino-9-boc-1,2,3,4-tetrahydro-carbazole-3-carboxylic Acid |
CAS: |
1031927-09-9 |
Synonyms: |
(R,S)-3-Boc-amino-9-boc-1,2,3,4-tetrahydro-carbazole-3-carboxylic acid; 9-[(2-methylpropan-2-yl)oxycarbonyl]-3-[(2-methylpropan-2-yl)oxycarbonylamino]-2,4-dihydro-1H-carbazole-3-carboxylic acid; 3-Amino-1,2,3,4-tetrahydro-9H-carbazole-3-carboxylic acid, N9,3-Bis-BOC protected; 3-Amino-1,2,3,4-tetrahydro-9H-carbazole-3-carboxylic acid,N9,3-Bis-BOC protected |
IUPAC Name: | 9-[(2-methylpropan-2-yl)oxycarbonyl]-3-[(2-methylpropan-2-yl)oxycarbonylamino]-2,4-dihydro-1H-carbazole-3-carboxylic acid |
Description: | (R,S)-3-Boc-amino-9-boc-1,2,3,4-tetrahydro-carbazole-3-carboxylic Acid is tetrahydrocarbazole based compound with Boc protected amines used as a building block in organic synthesis. |
Molecular Weight: | 430.49 |
Molecular Formula: | C23H30N2O6 |
Canonical SMILES: | CC(C)(C)OC(=O)NC1(CCC2=C(C1)C3=CC=CC=C3N2C(=O)OC(C)(C)C)C(=O)O |
InChI: | InChI=1S/C23H30N2O6/c1-21(2,3)30-19(28)24-23(18(26)27)12-11-17-15(13-23)14-9-7-8-10-16(14)25(17)20(29)31-22(4,5)6/h7-10H,11-13H2,1-6H3,(H,24,28)(H,26,27) |
InChI Key: | SWRSXXABCASEQK-UHFFFAOYSA-N |
Complexity: | 725 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 430.21038668 |
Formal Charge: | 0 |
Heavy Atom Count: | 31 |
Hydrogen Bond Acceptor Count: | 6 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 430.21038668 |
Rotatable Bond Count: | 6 |
Topological Polar Surface Area: | 107Ų |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 4.1 |
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