cis-2-(Boc-amino)cyclopentanecarboxylic Acid - CAS 136315-70-3
Catalog: |
BB008325 |
Product Name: |
cis-2-(Boc-amino)cyclopentanecarboxylic Acid |
CAS: |
136315-70-3 |
Synonyms: |
(1R,2S)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-cyclopentanecarboxylic acid; (1R,2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]cyclopentane-1-carboxylic acid |
IUPAC Name: | (1R,2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]cyclopentane-1-carboxylic acid |
Description: | cis-2-(Boc-amino)cyclopentanecarboxylic Acid (CAS# 136315-70-3) is a useful research chemical. |
Molecular Weight: | 229.27 |
Molecular Formula: | C11H19N 4 |
Canonical SMILES: | CC(C)(C)OC(=O)NC1CCCC1C(=O)O |
InChI: | InChI=1S/C11H19NO4/c1-11(2,3)16-10(15)12-8-6-4-5-7(8)9(13)14/h7-8H,4-6H2,1-3H3,(H,12,15)(H,13,14)/t7-,8+/m1/s1 |
InChI Key: | BUEPEVBYNBQNED-SFYZADRCSA-N |
Boiling Point: | 382.5 °C at 760 mmHg |
Appearance: | White to off-white powder |
LogP: | 2.15530 |
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 |
EP-3608326-A1 | Tricyclic inhibitors of hepatitis b virus | 20180810 |
WO-2020030781-A1 | Tricyclic inhibitors of hepatitis b virus | 20180810 |
CN-113272309-A | Tricyclic inhibitors of hepatitis B virus | 20180810 |
EP-3833672-A1 | Tricyclic inhibitors of hepatitis b virus | 20180810 |
JP-2018076368-A | Combination of hepatitis C virus inhibitors | 20180111 |
Complexity: | 282 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 2 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 229.13140809 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 229.13140809 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 75.6 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.9 |
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