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113854-98-1 | 4-Oxazolidinone, 3-[4-(octylamino)butyl]-
CAS No: 113854-98-1 Catalog No: AG0009XM MDL No:
Product Description
Catalog Number:
AG0009XM
Chemical Name:
4-Oxazolidinone, 3-[4-(octylamino)butyl]-
CAS Number:
113854-98-1
Molecular Formula:
C15H30N2O2
Molecular Weight:
270.4109
IUPAC Name:
3-[4-(octylamino)butyl]-1,3-oxazolidin-4-one
InChI:
InChI=1S/C15H30N2O2/c1-2-3-4-5-6-7-10-16-11-8-9-12-17-14-19-13-15(17)18/h16H,2-14H2,1H3
InChI Key:
BCLRRDQXGJJQAM-UHFFFAOYSA-N
SMILES:
CCCCCCCCNCCCCN1COCC1=O
Properties
Complexity:
234
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
270.231g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
270.417g/mol
Monoisotopic Mass:
270.231g/mol
Rotatable Bond Count:
12
Topological Polar Surface Area:
41.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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