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1017113-10-8

1017113-10-8 | 3-Morpholinone, 6-(aminomethyl)-4-butyl-

CAS No: 1017113-10-8 Catalog No: AG0005A7 MDL No:MFCD09891885

Product Description

Catalog Number:
AG0005A7
Chemical Name:
3-Morpholinone, 6-(aminomethyl)-4-butyl-
CAS Number:
1017113-10-8
Molecular Formula:
C9H18N2O2
Molecular Weight:
186.2514
MDL Number:
MFCD09891885
IUPAC Name:
6-(aminomethyl)-4-butylmorpholin-3-one
InChI:
InChI=1S/C9H18N2O2/c1-2-3-4-11-6-8(5-10)13-7-9(11)12/h8H,2-7,10H2,1H3
InChI Key:
BRCOYFZTOSVJIA-UHFFFAOYSA-N
SMILES:
CCCCN1CC(CN)OCC1=O

Properties

Complexity:
173  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
186.137g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
186.255g/mol
Monoisotopic Mass:
186.137g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
55.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2  

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