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24696-02-4 | L-Aspartic acid, N-(cyclohexylcarbonyl)-
CAS No: 24696-02-4 Catalog No: AG002P1U MDL No:
Product Description
Catalog Number:
AG002P1U
Chemical Name:
L-Aspartic acid, N-(cyclohexylcarbonyl)-
CAS Number:
24696-02-4
Molecular Formula:
C11H17NO5
Molecular Weight:
243.2564
IUPAC Name:
(2S)-2-(cyclohexanecarbonylamino)butanedioic acid
InChI:
InChI=1S/C11H17NO5/c13-9(14)6-8(11(16)17)12-10(15)7-4-2-1-3-5-7/h7-8H,1-6H2,(H,12,15)(H,13,14)(H,16,17)/t8-/m0/s1
InChI Key:
DGCLMFYGUFUUFF-QMMMGPOBSA-N
SMILES:
O=C(C1CCCCC1)N[C@H](C(=O)O)CC(=O)O
Properties
Complexity:
309
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
243.111g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
243.259g/mol
Monoisotopic Mass:
243.111g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
104A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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