4-(Boc-amino)cyclohexene - CAS 135262-85-0
Catalog: |
BB008118 |
Product Name: |
4-(Boc-amino)cyclohexene |
CAS: |
135262-85-0 |
Synonyms: |
N-(1-cyclohex-3-enyl)carbamic acid tert-butyl ester; tert-butyl N-cyclohex-3-en-1-ylcarbamate |
IUPAC Name: | tert-butyl N-cyclohex-3-en-1-ylcarbamate |
Description: | 4-(Boc-amino)cyclohexene (CAS# 135262-85-0 ) is a useful research chemical. |
Molecular Weight: | 197.27 |
Molecular Formula: | C11H19NO2 |
Canonical SMILES: | CC(C)(C)OC(=O)NC1CCC=CC1 |
InChI: | InChI=1S/C11H19NO2/c1-11(2,3)14-10(13)12-9-7-5-4-6-8-9/h4-5,9H,6-8H2,1-3H3,(H,12,13) |
InChI Key: | IRBIWNJTHWLIMD-UHFFFAOYSA-N |
LogP: | 2.82420 |
Publication Number | Title | Priority Date |
WO-2020142612-A1 | Pyrido-pyrimidinone and pteridinone compounds as inhibitors of endoribonuclease inositol requiring enzyme i (ire i alpha) for the treatment of cancer diseases. | 20190103 |
TW-202039466-A | Pyrido-pyrimidinone and pteridinone compounds and methods of use | 20190103 |
CN-113508115-A | Pyridopyrimidinone and pteridinone compounds as inhibitors of endoribonuclease inositol requiring enzyme I (IRE I A) for the treatment of cancer diseases | 20190103 |
WO-2019165290-A1 | Pyridine-sulfonamide compounds and their use against pain and related conditions | 20180226 |
JP-2020507601-A | Pyrrolo [1,2-b] pyridazine derivatives | 20170216 |
Complexity: | 228 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 197.141578849 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 197.141578849 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 38.3 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.5 |
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