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117318-88-4

117318-88-4 | 2-Propenoic acid, 2-methyl-, 2-[[(hexylamino)carbonyl]amino]ethyl ester

CAS No: 117318-88-4 Catalog No: AG000E4F MDL No:

Product Description

Catalog Number:
AG000E4F
Chemical Name:
2-Propenoic acid, 2-methyl-, 2-[[(hexylamino)carbonyl]amino]ethyl ester
CAS Number:
117318-88-4
Molecular Formula:
C13H24N2O3
Molecular Weight:
256.3413
IUPAC Name:
2-(hexylcarbamoylamino)ethyl 2-methylprop-2-enoate
InChI:
InChI=1S/C13H24N2O3/c1-4-5-6-7-8-14-13(17)15-9-10-18-12(16)11(2)3/h2,4-10H2,1,3H3,(H2,14,15,17)
InChI Key:
LHCBDXUUZALYCB-UHFFFAOYSA-N
SMILES:
CCCCCCNC(=O)NCCOC(=O)C(=C)C

Properties

Complexity:
277  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
256.179g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
256.346g/mol
Monoisotopic Mass:
256.179g/mol
Rotatable Bond Count:
10  
Topological Polar Surface Area:
67.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  

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