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1421-89-2 | Acetic acid, 2-(dimethylamino)ethyl ester
CAS No: 1421-89-2 Catalog No: AG001HSW MDL No:MFCD00041912
Product Description
Catalog Number:
AG001HSW
Chemical Name:
Acetic acid, 2-(dimethylamino)ethyl ester
CAS Number:
1421-89-2
Molecular Formula:
C6H13NO2
Molecular Weight:
131.1729
MDL Number:
MFCD00041912
IUPAC Name:
2-(dimethylamino)ethyl acetate
InChI:
InChI=1S/C6H13NO2/c1-6(8)9-5-4-7(2)3/h4-5H2,1-3H3
InChI Key:
GOLSFPMYASLXJC-UHFFFAOYSA-N
SMILES:
CN(CCOC(=O)C)C
EC Number:
215-827-4
UNII:
ERL2MM8I7X
NSC Number:
7511
Properties
Complexity:
91.1
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
131.095g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
131.175g/mol
Monoisotopic Mass:
131.095g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2
Literature
| Title | Journal |
|---|---|
| Synthesis of novel cationic bolaamphiphiles from vernonia oil and their aggregated structures. | Chemistry and physics of lipids 20080601 |
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