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124-17-4 | Ethanol, 2-(2-butoxyethoxy)-, 1-acetate
CAS No: 124-17-4 Catalog No: AG000LDJ MDL No:MFCD00009458
Product Description
Catalog Number:
AG000LDJ
Chemical Name:
Ethanol, 2-(2-butoxyethoxy)-, 1-acetate
CAS Number:
124-17-4
Molecular Formula:
C10H20O4
Molecular Weight:
204.2634
MDL Number:
MFCD00009458
IUPAC Name:
2-(2-butoxyethoxy)ethyl acetate
InChI:
InChI=1S/C10H20O4/c1-3-4-5-12-6-7-13-8-9-14-10(2)11/h3-9H2,1-2H3
InChI Key:
VXQBJTKSVGFQOL-UHFFFAOYSA-N
SMILES:
CCCCOCCOCCOC(=O)C
EC Number:
204-685-9
UNII:
U6UTS77LXB
RTECS Number:
KJ9275000
Properties
Complexity:
136
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.136g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
204.266g/mol
Monoisotopic Mass:
204.136g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
44.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
Literature
| Title | Journal |
|---|---|
| Screening of endocrine activity of compounds migrating from plastic baby bottles using a multi-receptor panel of in vitro bioassays. | Toxicology in vitro : an international journal published in association with BIBRA 20161201 |
| Biomonitoring of 2-(2-alkoxyethoxy)ethanols by analysing urinary 2-(2-alkoxyethoxy)acetic acids. | Toxicology letters 20050328 |
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