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14429-43-7 | Cyclohexaneacetic acid, α-(acetylamino)-, (αR)-
CAS No: 14429-43-7 Catalog No: AG001J94 MDL No:MFCD09991565
Product Description
Catalog Number:
AG001J94
Chemical Name:
Cyclohexaneacetic acid, α-(acetylamino)-, (αR)-
CAS Number:
14429-43-7
Molecular Formula:
C10H17NO3
Molecular Weight:
199.2469
MDL Number:
MFCD09991565
IUPAC Name:
(2R)-2-acetamido-2-cyclohexylacetic acid
InChI:
InChI=1S/C10H17NO3/c1-7(12)11-9(10(13)14)8-5-3-2-4-6-8/h8-9H,2-6H2,1H3,(H,11,12)(H,13,14)/t9-/m1/s1
InChI Key:
CVVVAKVOCWNDLJ-SECBINFHSA-N
SMILES:
OC(=O)[C@@H](C1CCCCC1)NC(=O)C
Properties
Complexity:
221
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
199.121g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
199.25g/mol
Monoisotopic Mass:
199.121g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
66.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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