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78279-10-4 | 2-Propenoic acid,2-methyl-, 2-[[[[(1-methylpropylidene)amino]oxy]carbonyl]amino]ethyl ester
CAS No: 78279-10-4 Catalog No: AG005C0O MDL No:
Product Description
Catalog Number:
AG005C0O
Chemical Name:
2-Propenoic acid,2-methyl-, 2-[[[[(1-methylpropylidene)amino]oxy]carbonyl]amino]ethyl ester
CAS Number:
78279-10-4
Molecular Formula:
C11H18N2O4
Molecular Weight:
242.2716
IUPAC Name:
2-[(butan-2-ylideneamino)oxycarbonylamino]ethyl 2-methylprop-2-enoate
InChI:
InChI=1S/C11H18N2O4/c1-5-9(4)13-17-11(15)12-6-7-16-10(14)8(2)3/h2,5-7H2,1,3-4H3,(H,12,15)
InChI Key:
AILNGZQURMVSDH-UHFFFAOYSA-N
SMILES:
CCC(=NOC(=O)NCCOC(=O)C(=C)C)C
Properties
Complexity:
323
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
242.127g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
242.275g/mol
Monoisotopic Mass:
242.127g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
77A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
1.5
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