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20811-87-4 | Benzenepropanoic acid, β-phenyl-, 1,2,2,6,6-pentamethyl-4-piperidinyl ester
CAS No: 20811-87-4 Catalog No: AG002JHM MDL No:
Product Description
Catalog Number:
AG002JHM
Chemical Name:
Benzenepropanoic acid, β-phenyl-, 1,2,2,6,6-pentamethyl-4-piperidinyl ester
CAS Number:
20811-87-4
Molecular Formula:
C25H33NO2
Molecular Weight:
379.5350
IUPAC Name:
(1,2,2,6,6-pentamethylpiperidin-4-yl) 3,3-diphenylpropanoate
InChI:
InChI=1S/C25H33NO2/c1-24(2)17-21(18-25(3,4)26(24)5)28-23(27)16-22(19-12-8-6-9-13-19)20-14-10-7-11-15-20/h6-15,21-22H,16-18H2,1-5H3
InChI Key:
JKYLARUULDDGFQ-UHFFFAOYSA-N
SMILES:
CN1C(C)(C)CC(CC1(C)C)OC(=O)CC(c1ccccc1)c1ccccc1
Properties
Complexity:
479
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
379.251g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
379.544g/mol
Monoisotopic Mass:
379.251g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.3
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