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101979-26-4 | 2-Propenoic acid, 2-[(1-oxodecyl)amino]-, methyl ester
CAS No: 101979-26-4 Catalog No: AG000654 MDL No:
Product Description
Catalog Number:
AG000654
Chemical Name:
2-Propenoic acid, 2-[(1-oxodecyl)amino]-, methyl ester
CAS Number:
101979-26-4
Molecular Formula:
C14H25NO3
Molecular Weight:
255.3532
IUPAC Name:
methyl 2-(decanoylamino)prop-2-enoate
InChI:
InChI=1S/C14H25NO3/c1-4-5-6-7-8-9-10-11-13(16)15-12(2)14(17)18-3/h2,4-11H2,1,3H3,(H,15,16)
InChI Key:
GYMSAPPTKIPBPF-UHFFFAOYSA-N
SMILES:
CCCCCCCCCC(=O)NC(=C)C(=O)OC
Properties
Complexity:
274
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
255.183g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
255.358g/mol
Monoisotopic Mass:
255.183g/mol
Rotatable Bond Count:
11
Topological Polar Surface Area:
55.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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