Compound Summary
DIBROMOACETIC ACID
Compound Information
DIBROMOACETIC ACID
Compound Name: | DIBROMOACETIC ACID |
Compound CID: | 12433 |
Synonyms: | DIBROMOACETIC ACID 2,2-dibromoacetic acid 631-64-1 Acetic acid, dibromo- Dibromoaceticacid More... |
Iupac Name: | 2,2-dibromoacetic acid |
InChI: | InChI=1S/C2H2Br2O2/c3-1(4)2(5)6/h1H,(H,5,6) |
InChIKey: | SIEILFNCEFEENQ-UHFFFAOYSA-N |
Canonical Smiles: | C(C(=O)O)(Br)Br |
Isomeric Smiles: | C(C(=O)O)(Br)Br |
Molecular Weight: | 217.84 |
Molecular Formula: | C2H2Br2O2 |
Compound Structure
2D Structure:
3D Structure:
Computed Properties
DIBROMOACETIC ACID
Molecular Weight: | 217.84 |
Molecular Formula: | C2H2Br2O2 |
Hydrogen Bond Donor Count: | 1 |
Hydrogen Bond Acceptor Count: | 2 |
Rotatable Bond Count: | 1 |
Heavy Atom Count: | 6 |
Complexity: | 60.6 |
Synonyms
DIBROMOACETIC ACID
| DIBROMOACETIC ACID | DIBROMOACETIC ACID |
|---|---|
DIBROMOACETIC ACID |
2,2-dibromoacetic acid |
631-64-1 |
Acetic acid, dibromo- |
Dibromoaceticacid |
2,2-dibromoethanoic acid |
UNII-7FUW62YY5L |
Dibromoethanoic acid |
DBAA |
7FUW62YY5L |
Acetic acid, 2,2-dibromo- |
10024-50-7 |
Dibromoacetate |
CHEBI:90124 |
DSSTox_CID_3815 |
DSSTox_RID_77196 |
DSSTox_GSID_23815 |
CAS-631-64-1 |
CCRIS 7636 |
EINECS 211-165-5 |
C2H2Br2O2 |
HSDB 7622 |
Dibromoacetic acid, 97% |
MLS001065597 |
SCHEMBL137199 |
CHEMBL449362 |
DTXSID1023815 |
ZINC4521378 |
Tox21_202297 |
Tox21_303291 |
6811AF |
LMFA01090076 |
AKOS000119767 |
Dibromoacetic acid, analytical standard |
MCULE-4908900588 |
NCGC00090913-01 |
NCGC00090913-02 |
NCGC00257152-01 |
NCGC00259846-01 |
SMR000568475 |
DB-054415 |
FT-0632681 |
C20123 |
Q18533477 |
Dibromoacetic acid 1000 microg/mL in Methyl-tert-butyl ether |
Experimental Data
DIBROMOACETIC ACID
| Species | Dose | Unit | Control(Avg days) | Treatment(Avg days) | Avg/Med Lifespan Change(%) | Control(Max days) | Treatment(Max days) | Max Lifespan Change(%) | Significant | Strain | Gender | PubMed | Avg/Med Lifespan Change tab |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Caenorhabditis elegans | 2.000000000000000 | umol/L | Unclear | N2 | 33683565 | ||||||||
| Caenorhabditis elegans | 10.000000000000000 | umol/L | Unclear | N2 | 33683565 | ||||||||
| Caenorhabditis elegans | 0.100000000000000 | mM | Unclear | N2 | 33683565 | ||||||||
| Caenorhabditis elegans | 0.500000000000000 | umol/L | Unclear | N2 | 33683565 | ||||||||
| Caenorhabditis elegans | 100.000000000000000 | umol/L | 14.570000000000000 | 0.760000000000000 | S | N2 | 33683565 | Active | |||||
| Caenorhabditis elegans | 50.000000000000000 | umol/L | 7.650000000000000 | 6.590000000000000 | S | N2 | 33683565 | Active | |||||
| Caenorhabditis elegans | 50.000000000000000 | umol/L | 18.190000000000000 | 19.800000000000000 | 0.090000000000000 | 22.650000000000000 | 24.120000000000000 | 0.060000000000000 | S | N2 | 25556763 | Active | |
| Caenorhabditis elegans | 100.000000000000000 | umol/L | 15.500000000000000 | 17.760000000000000 | 0.150000000000000 | 21.650000000000000 | 21.810000000000000 | 0.010000000000000 | S | N2 | 25556763 | Active |
Experimental Data Visualization
DIBROMOACETIC ACID
Statistics Data
DIBROMOACETIC ACID
| Species | Avg/Med Lifespan Change(%) | Max Lifespan Change(%) | Count Reference | Count Data point |
|---|---|---|---|---|
| Caenorhabditis elegans | 14.570000000000000 | 6.590000000000000 | 2 | 8 |
Statistics Data Visualization
DIBROMOACETIC ACID
