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10264-17-2 | Butanamide, N-hexyl-
CAS No: 10264-17-2 Catalog No: AG000804 MDL No:MFCD03387598
Product Description
Catalog Number:
AG000804
Chemical Name:
Butanamide, N-hexyl-
CAS Number:
10264-17-2
Molecular Formula:
C10H21NO
Molecular Weight:
171.2798
MDL Number:
MFCD03387598
IUPAC Name:
N-hexylbutanamide
InChI:
InChI=1S/C10H21NO/c1-3-5-6-7-9-11-10(12)8-4-2/h3-9H2,1-2H3,(H,11,12)
InChI Key:
YRVDTEDFGDNSLD-UHFFFAOYSA-N
SMILES:
CCCCCCNC(=O)CCC
Properties
Complexity:
112
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
171.162g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
171.284g/mol
Monoisotopic Mass:
171.162g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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