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101418-11-5 | Carbonic acid, ethyl 1-methyl-4-phenyl-4-piperidinyl ester
CAS No: 101418-11-5 Catalog No: AG0004G8 MDL No:
Product Description
Catalog Number:
AG0004G8
Chemical Name:
Carbonic acid, ethyl 1-methyl-4-phenyl-4-piperidinyl ester
CAS Number:
101418-11-5
Molecular Formula:
C15H21NO3
Molecular Weight:
263.3321
IUPAC Name:
(2-ethyl-1-methyl-4-phenylpiperidin-4-yl) carbonate
InChI:
InChI=1S/C15H21NO3/c1-3-13-11-15(19-14(17)18,9-10-16(13)2)12-7-5-4-6-8-12/h4-8,13H,3,9-11H2,1-2H3,(H,17,18)/p-1
InChI Key:
AJJHXBGGRJDKOB-UHFFFAOYSA-M
SMILES:
CCOC(=O)OC1(CCN(CC1)C)c1ccccc1
Properties
Complexity:
309
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
262.144g/mol
Formal Charge:
-1
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
262.329g/mol
Monoisotopic Mass:
262.144g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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