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138688-99-0 | L-Glutamic acid, 1-[5-methyl-2-(1-methylethyl)cyclohexyl] ester
CAS No: 138688-99-0 Catalog No: AG001909 MDL No:
Product Description
Catalog Number:
AG001909
Chemical Name:
L-Glutamic acid, 1-[5-methyl-2-(1-methylethyl)cyclohexyl] ester
CAS Number:
138688-99-0
Molecular Formula:
C15H26NO4-
Molecular Weight:
284.3712
IUPAC Name:
4-amino-5-(5-methyl-2-propan-2-ylcyclohexyl)oxy-5-oxopentanoate
InChI:
InChI=1S/C15H27NO4/c1-9(2)11-5-4-10(3)8-13(11)20-15(19)12(16)6-7-14(17)18/h9-13H,4-8,16H2,1-3H3,(H,17,18)/p-1
InChI Key:
NENRFELFQXSTSG-UHFFFAOYSA-M
SMILES:
CC1CCC(C(C1)OC(=O)[C@H](CCC(=O)[O-])N)C(C)C
Properties
Complexity:
337
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
284.186g/mol
Formal Charge:
-1
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
284.376g/mol
Monoisotopic Mass:
284.186g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
92.4A^2
Undefined Atom Stereocenter Count:
4
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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