(3-Oxopiperazin-1-yl)acetic acid - CAS 25629-32-7
Catalog: |
BB018978 |
Product Name: |
(3-Oxopiperazin-1-yl)acetic acid |
CAS: |
25629-32-7 |
Synonyms: |
2-(3-oxopiperazin-1-yl)acetic acid |
IUPAC Name: | 2-(3-oxopiperazin-1-yl)acetic acid |
Description: | (3-Oxopiperazin-1-yl)acetic acid (CAS# 25629-32-7) is a useful research chemical. |
Molecular Weight: | 158.16 |
Molecular Formula: | C6H10N2O3 |
Canonical SMILES: | C1CN(CC(=O)N1)CC(=O)O |
InChI: | InChI=1S/C6H10N2O3/c9-5-3-8(2-1-7-5)4-6(10)11/h1-4H2,(H,7,9)(H,10,11) |
InChI Key: | FDDVFMDIVCWGKS-UHFFFAOYSA-N |
MDL: | MFCD06653413 |
LogP: | -1.23050 |
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 |
AU-2014240129-A1 | Tripeptide epoxy ketone protease inhibitors | 20130314 |
AU-2014240129-B2 | Tripeptide epoxy ketone protease inhibitors | 20130314 |
CA-2903720-A1 | Tripeptide epoxy ketone protease inhibitors | 20130314 |
DK-2970224-T3 | TRIPEPTIDEPOXYKETONE PROTEASE INHIBITORS | 20130314 |
EA-029548-B1 | TRIPEPTIDE EPOKEKETONE PROTEASE INHIBITORS | 20130314 |
Complexity: | 181 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 158.06914219 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 158.06914219 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 69.6 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -3.3 |
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