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72469-37-5

72469-37-5 | 2-Propenamide, N-(1-methylpentyl)-

CAS No: 72469-37-5 Catalog No: AG005HFB MDL No:

Product Description

Catalog Number:
AG005HFB
Chemical Name:
2-Propenamide, N-(1-methylpentyl)-
CAS Number:
72469-37-5
Molecular Formula:
C9H17NO
Molecular Weight:
155.2374
IUPAC Name:
N-hexan-2-ylprop-2-enamide
InChI:
InChI=1S/C9H17NO/c1-4-6-7-8(3)10-9(11)5-2/h5,8H,2,4,6-7H2,1,3H3,(H,10,11)
InChI Key:
JXRGQGSCLOUNTL-UHFFFAOYSA-N
SMILES:
CC(NC(=O)C=C)CCCC

Properties

Complexity:
132  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
155.131g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
155.241g/mol
Monoisotopic Mass:
155.131g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  

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