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89761-49-9 | 2-Propenoic acid, 2-methyl-, 2-[[(pentyloxy)carbonyl]amino]ethyl ester
CAS No: 89761-49-9 Catalog No: AG0040T7 MDL No:
Product Description
Catalog Number:
AG0040T7
Chemical Name:
2-Propenoic acid, 2-methyl-, 2-[[(pentyloxy)carbonyl]amino]ethyl ester
CAS Number:
89761-49-9
Molecular Formula:
C12H21NO4
Molecular Weight:
243.2994
IUPAC Name:
2-(pentoxycarbonylamino)ethyl 2-methylprop-2-enoate
InChI:
InChI=1S/C12H21NO4/c1-4-5-6-8-17-12(15)13-7-9-16-11(14)10(2)3/h2,4-9H2,1,3H3,(H,13,15)
InChI Key:
NCNQNCRGMKRLOK-UHFFFAOYSA-N
SMILES:
CCCCCOC(=O)NCCOC(=O)C(=C)C
Properties
Complexity:
263
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
243.147g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
243.303g/mol
Monoisotopic Mass:
243.147g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
64.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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