CAS
954239-03-3 Purity
96%
954239-03-3 Purity
96%
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1-Boc-6-iodo-2,3-dihydro-indole
CAS
954239-34-0
Catalog Number
ACM954239340
Category
Other Products
Molecular Weight
345.1794
Molecular Formula
C13H16InO2
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Specification
Synonyms
1-BOC-6-IODO-2,3-DIHYDRO-INDOLE
MDL Number
MFCD08752593
Size
500mg,1g,5g
What is the molecular formula of 1-Boc-6-iodo-2,3-dihydro-indole?
The molecular formula is C13H16INO2.
What is the molecular weight of 1-Boc-6-iodo-2,3-dihydro-indole?
The molecular weight is 345.18 g/mol.
What is the IUPAC name of 1-Boc-6-iodo-2,3-dihydro-indole?
The IUPAC name is tert-butyl 6-iodo-2,3-dihydroindole-1-carboxylate.
What is the InChI of 1-Boc-6-iodo-2,3-dihydro-indole?
The InChI is InChI=1S/C13H16INO2/c1-13(2,3)17-12(16)15-7-6-9-4-5-10(14)8-11(9)15/h4-5,8H,6-7H2,1-3H3.
What is the InChIKey of 1-Boc-6-iodo-2,3-dihydro-indole?
The InChIKey is QSKPZRCADFMYNI-UHFFFAOYSA-N.
What is the canonical SMILES of 1-Boc-6-iodo-2,3-dihydro-indole?
The canonical SMILES is CC(C)(C)OC(=O)N1CCC2=C1C=C(C=C2)I.
What is the XLogP3-AA of 1-Boc-6-iodo-2,3-dihydro-indole?
The XLogP3-AA is 3.4.
How many hydrogen bond donor counts does 1-Boc-6-iodo-2,3-dihydro-indole have?
It has 0 hydrogen bond donor counts.
How many hydrogen bond acceptor counts does 1-Boc-6-iodo-2,3-dihydro-indole have?
It has 2 hydrogen bond acceptor counts.
How many rotatable bond counts does 1-Boc-6-iodo-2,3-dihydro-indole have?
It has 2 rotatable bond counts.
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