2-(2-Butoxyethoxy)Ethanol
PubChem CID: 8177
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| Compound Synonyms | 2-(2-Butoxyethoxy)ethanol, 112-34-5, Butyldiglycol, DIETHYLENE GLYCOL MONOBUTYL ETHER, Butyl carbitol, Diethylene glycol butyl ether, Butoxydiglycol, Ethanol, 2-(2-butoxyethoxy)-, Butyl diglycol, Butyl dioxitol, Butyl digol, Butoxyethoxyethanol, BUCB, Dowanol DB, Glycol ether DB, Jeffersol db, Diethylene glycol mono-n-butyl ether, Ektasolve DB, Butoxydiethylene glycol, Diglycol monobutyl ether, O-Butyl diethylene glycol, Butyl Ethyl Cellosolve, Caswell No. 121B, Caswell No. 125H, Butoxy diethylene glycol, Diethylene glycol n-butyl ether, 3,6-Dioxadecanol, Diethylene gylcol monobutyl ether, CCRIS 5321, HSDB 333, Butyl di-icinol, Diethylene DB, UNII-9TB90IYC0E, EINECS 203-961-6, 2-(2-n-Butoxyethoxy)ethanol, EPA Pesticide Chemical Code 011502, NSC 407762, BRN 1739225, DTXSID8021519, Ethanol, 2,2'-oxybis-, monobutyl ether, Monobutyl diethylene glycol ether, AI3-01954, Ethanol 2-butoxyethoxy, NSC-407762, 9TB90IYC0E, 2-(2-butoxyethoxy)-ethanol, Diethylene glycol butyl ester, DTXCID001519, EC 203-961-6, DIETHYLENE GLYCOL MONOBUTYL ETHER [MI], DIETHYLENE GLYCOL MONO-N-BUTYL ETHER [HSDB], n-Butyl carbitol, Diethylene glycol butyl ether, >=99%, CAS-112-34-5, DEGBE, 2-(2-butoxyethoxy)ethan-1-ol, 3,6-Dioxa-1-decanol, 2-(2-butoxyethoxy) ethanol, Butyldigol, Butadigol, PolySolv DB, butyl diglycol ether, MFCD00002881, BUTYLCARBITOL, DIEHYLENE DB, BDG-NS, OButyl diethylene glycol, 2(2Butoxyethoxy)ethanol, NBC (SOLVENT), Butyl Oxitol glycol ether, 2-(n-Butoxyethoxy)ethanol, Ethanol, 2(2butoxyethoxy), Pesticide Code: 011502, SCHEMBL15619, diethyleneglycol monobutylether, diethyleneglycol n-butyl ether, Diethylene glycol nbutyl ether, WLN: Q2O2O4, diethyleneglycol monobutyl ether, CHEMBL1904721, diethylene glycol-monobutyl ether, CHEBI:195270, Tox21_202404, Tox21_300084, 2-(BETA-BUTOXYETHOXY)ETHANOL, Ethanol,2'-oxybis-, monobutyl ether, NSC407762, AKOS009156535, butoxydiethylene glycol, butoxydiglycol, Ethanol, 2,2'oxybis, monobutyl ether, Diethylene glycol monobutyl ether, 98%, NCGC00164235-01, NCGC00164235-02, NCGC00164235-03, NCGC00253937-01, NCGC00259953-01, LS-13547, B0699, NS00007962, EN300-206638, F71187, K 50181, Diethylene glycol monobutyl ether, >=98.0% (GC), Q1018210, Diethylene glycol butyl ether, SAJ special grade, >=99.0%, DIETHYLENE GLYCOL MONOBUTYL ETHER (BUTYL CARBITOL), Diethylene glycol monobutyl ether, for surfactant analysis, >=99.0% |
|---|---|
| Ghose Rule | True |
| Classyfire Kingdom | Organic compounds |
| Topological Polar Surface Area | 38.7 |
| Hydrogen Bond Donor Count | 1.0 |
| Pfizer 3 75 Rule | False |
| Deep Smiles | CCCCOCCOCCO |
| Heavy Atom Count | 11.0 |
| Classyfire Class | Organooxygen compounds |
| Classyfire Subclass | Ethers |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 66.4 |
| Database Name | cmaup_ingredients;imppat_phytochem;npass_chem_all;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Uniprot Id | P10275, Q03181, P19838 |
| Iupac Name | 2-(2-butoxyethoxy)ethanol |
| Prediction Hob | 1.0 |
| Veber Rule | True |
| Classyfire Superclass | Organic oxygen compounds |
| Xlogp | 0.6 |
| Gsk 4 400 Rule | True |
| Molecular Formula | C8H18O3 |
| Prediction Swissadme | 0.0 |
| Inchi Key | OAYXUHPQHDHDDZ-UHFFFAOYSA-N |
| Silicos It Class | Soluble |
| Fcsp3 | 1.0 |
| Logs | 0.449 |
| Rotatable Bond Count | 8.0 |
| Logd | 0.795 |
| Synonyms | 2-(2-butoxyethoxy)-ethanol |
| Esol Class | Very soluble |
| Functional Groups | CO, COC |
| Compound Name | 2-(2-Butoxyethoxy)Ethanol |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 162.126 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 162.126 |
| Hydrogen Bond Acceptor Count | 3.0 |
| Molecular Weight | 162.23 |
| Gi Absorption | True |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 0.0 |
| Lipinski Rule Of 5 | True |
| Esol | -0.6706197999999999 |
| Inchi | InChI=1S/C8H18O3/c1-2-3-5-10-7-8-11-6-4-9/h9H,2-8H2,1H3 |
| Smiles | CCCCOCCOCCO |
| Nring | 0.0 |
| Np Classifier Biosynthetic Pathway | Fatty acids |
| Defined Bond Stereocenter Count | 0.0 |
| Egan Rule | True |
- 1. Outgoing r'ship
FOUND_INto/from Chaenomeles Sinensis (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 2. Outgoing r'ship
FOUND_INto/from Thymus Serpyllum (Plant) Rel Props:Reference:https://doi.org/10.1080/0972060x.2005.10643419