trans-4-[(Boc-amino)methyl]cyclohexanecarbaldehyde - CAS 180046-90-6
Catalog: |
BB013640 |
Product Name: |
trans-4-[(Boc-amino)methyl]cyclohexanecarbaldehyde |
CAS: |
180046-90-6 |
Synonyms: |
N-[(4-formylcyclohexyl)methyl]carbamic acid tert-butyl ester; tert-butyl N-[(4-formylcyclohexyl)methyl]carbamate |
IUPAC Name: | tert-butyl N-[(4-formylcyclohexyl)methyl]carbamate |
Description: | trans-4-[(Boc-amino)methyl]cyclohexanecarbaldehyde (CAS# 180046-90-6 ) is a useful research chemical. |
Molecular Weight: | 241.33 |
Molecular Formula: | C13H23NO3 |
Canonical SMILES: | CC(C)(C)OC(=O)NCC1CCC(CC1)C=O |
InChI: | InChI=1S/C13H23NO3/c1-13(2,3)17-12(16)14-8-10-4-6-11(9-15)7-5-10/h9-11H,4-8H2,1-3H3,(H,14,16) |
InChI Key: | NYVWCWFKYRHGOP-UHFFFAOYSA-N |
LogP: | 2.90730 |
Publication Number | Title | Priority Date |
WO-2021188948-A1 | Mdm2 degraders and uses thereof | 20200319 |
US-2020054623-A1 | Chemokine CXCR4 Receptor Modulators and Uses Related Thereto | 20170221 |
US-10280229-B2 | Linkers and their application towards ADC | 20140716 |
US-2017202974-A1 | Linkers and their application towards adc | 20140716 |
WO-2016008392-A1 | Linkers and their application towards adc | 20140716 |
Complexity: | 262 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 241.1677936 |
Formal Charge: | 0 |
Heavy Atom Count: | 17 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 241.1677936 |
Rotatable Bond Count: | 5 |
Topological Polar Surface Area: | 55.4 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.9 |
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