trans-3-(Boc-amino)cyclopentanol - CAS 207729-04-2
Catalog: |
BB016272 |
Product Name: |
trans-3-(Boc-amino)cyclopentanol |
CAS: |
207729-04-2 |
Synonyms: |
N-[(1R,3R)-3-hydroxycyclopentyl]carbamic acid tert-butyl ester; tert-butyl N-[(1R,3R)-3-hydroxycyclopentyl]carbamate |
IUPAC Name: | tert-butyl N-[(1R,3R)-3-hydroxycyclopentyl]carbamate |
Description: | trans-3-(Boc-amino)cyclopentanol (CAS# 207729-04-2) is a useful research chemical. |
Molecular Weight: | 201.26 |
Molecular Formula: | C10H19NO3 |
Canonical SMILES: | CC(C)(C)OC(=O)NC1CCC(C1)O |
InChI: | InChI=1S/C10H19NO3/c1-10(2,3)14-9(13)11-7-4-5-8(12)6-7/h7-8,12H,4-6H2,1-3H3,(H,11,13)/t7-,8-/m1/s1 |
InChI Key: | SBUKINULYZANSP-HTQZYQBOSA-N |
Appearance: | White to yellow solid |
LogP: | 1.81540 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
WO-2019210835-A1 | Diaryl macrocyclic compound as protein kinase modulator | 20180504 |
CN-111918868-A | Diaryl macrocycles as protein kinase modulators | 20180504 |
US-2019248777-A1 | Isoxazole derivatives as fxr agonists and methods of use thereof | 20180214 |
WO-2019160813-A1 | Isoxazole derivatives as fxr agonists and methods of use thereof | 20180214 |
US-10829486-B2 | Isoxazole derivatives as FXR agonists and methods of use thereof | 20180214 |
Complexity: | 210 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 2 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 201.13649347 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 201.13649347 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 58.6 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.2 |
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