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114781-14-5 | D-Norleucine, 2-ethyl-
CAS No: 114781-14-5 Catalog No: AG000F7S MDL No:MFCD05663537
Product Description
Catalog Number:
AG000F7S
Chemical Name:
D-Norleucine, 2-ethyl-
CAS Number:
114781-14-5
Molecular Formula:
C8H17NO2
Molecular Weight:
159.2261
MDL Number:
MFCD05663537
IUPAC Name:
(2R)-2-amino-2-ethylhexanoic acid
InChI:
InChI=1S/C8H17NO2/c1-3-5-6-8(9,4-2)7(10)11/h3-6,9H2,1-2H3,(H,10,11)/t8-/m1/s1
InChI Key:
QUDXVGQYPUXXER-MRVPVSSYSA-N
SMILES:
CCCC[C@@](C(=O)O)(CC)N
Properties
Complexity:
136
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
159.126g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
159.229g/mol
Monoisotopic Mass:
159.126g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
63.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.9
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