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89248-92-0 | 4-Oxazolidineheptanoic acid, 3-(3-cyclopentyl-3-hydroxypropyl)-2-oxo-
CAS No: 89248-92-0 Catalog No: AG00882J MDL No:
Product Description
Catalog Number:
AG00882J
Chemical Name:
4-Oxazolidineheptanoic acid, 3-(3-cyclopentyl-3-hydroxypropyl)-2-oxo-
CAS Number:
89248-92-0
Molecular Formula:
C18H31NO5
Molecular Weight:
341.4424
IUPAC Name:
7-[3-(3-cyclopentyl-3-hydroxypropyl)-2-oxo-1,3-oxazolidin-4-yl]heptanoic acid
InChI:
InChI=1S/C18H31NO5/c20-16(14-7-5-6-8-14)11-12-19-15(13-24-18(19)23)9-3-1-2-4-10-17(21)22/h14-16,20H,1-13H2,(H,21,22)
InChI Key:
AGXIDBAPGIUKBM-UHFFFAOYSA-N
SMILES:
OC(=O)CCCCCCC1COC(=O)N1CCC(C1CCCC1)O
Properties
Complexity:
408
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
341.22g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
341.448g/mol
Monoisotopic Mass:
341.22g/mol
Rotatable Bond Count:
11
Topological Polar Surface Area:
87.1A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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