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86178-63-4 | BIS(2-(DIMETHYLAMINO)ETHYL) MALEATE
CAS No: 86178-63-4 Catalog No: AG004TJ2 MDL No:
Product Description
Catalog Number:
AG004TJ2
Chemical Name:
BIS(2-(DIMETHYLAMINO)ETHYL) MALEATE
CAS Number:
86178-63-4
Molecular Formula:
C12H22N2O4
Molecular Weight:
258.3141
IUPAC Name:
bis[2-(dimethylamino)ethyl] (Z)-but-2-enedioate
InChI:
InChI=1S/C12H22N2O4/c1-13(2)7-9-17-11(15)5-6-12(16)18-10-8-14(3)4/h5-6H,7-10H2,1-4H3/b6-5-
InChI Key:
HAHZVQOXFHJPOX-WAYWQWQTSA-N
SMILES:
CN(CCOC(=O)/C=C\C(=O)OCCN(C)C)C
EC Number:
289-201-4
Properties
Complexity:
260
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
258.158g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
258.318g/mol
Monoisotopic Mass:
258.158g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
59.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
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