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3089-23-4 | 2-Propenoic acid, 2-methyl-, 2-oxo-2-[[2-(2-oxo-1-imidazolidinyl)ethyl]amino]ethyl ester
CAS No: 3089-23-4 Catalog No: AG0031MA MDL No:
Product Description
Catalog Number:
AG0031MA
Chemical Name:
2-Propenoic acid, 2-methyl-, 2-oxo-2-[[2-(2-oxo-1-imidazolidinyl)ethyl]amino]ethyl ester
CAS Number:
3089-23-4
Molecular Formula:
C11H17N3O4
Molecular Weight:
255.2704
IUPAC Name:
[2-oxo-2-[2-(2-oxoimidazolidin-1-yl)ethylamino]ethyl] 2-methylprop-2-enoate
InChI:
InChI=1S/C11H17N3O4/c1-8(2)10(16)18-7-9(15)12-3-5-14-6-4-13-11(14)17/h1,3-7H2,2H3,(H,12,15)(H,13,17)
InChI Key:
BMMZGRLRFPSWKY-UHFFFAOYSA-N
SMILES:
O=C(COC(=O)C(=C)C)NCCN1CCNC1=O
EC Number:
221-428-6
UNII:
AX5Y3887TT
Properties
Complexity:
367
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
255.122g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
255.274g/mol
Monoisotopic Mass:
255.122g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
87.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.5
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