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1461-78-5 | 1-Pyrrolidinecarboxamide, N-butyl-
CAS No: 1461-78-5 Catalog No: AG001DOQ MDL No:
Product Description
Catalog Number:
AG001DOQ
Chemical Name:
1-Pyrrolidinecarboxamide, N-butyl-
CAS Number:
1461-78-5
Molecular Formula:
C9H18N2O
Molecular Weight:
170.2520
IUPAC Name:
N-butylpyrrolidine-1-carboxamide
InChI:
InChI=1S/C9H18N2O/c1-2-3-6-10-9(12)11-7-4-5-8-11/h2-8H2,1H3,(H,10,12)
InChI Key:
UORJYVGJSYXIOP-UHFFFAOYSA-N
SMILES:
CCCCNC(=O)N1CCCC1
Properties
Complexity:
142
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
170.142g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
170.256g/mol
Monoisotopic Mass:
170.142g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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