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86967-47-7 | 1-Pentanamine, N-pentyl-N-2-propenyl-
CAS No: 86967-47-7 Catalog No: AG004L3V MDL No:
Product Description
Catalog Number:
AG004L3V
Chemical Name:
1-Pentanamine, N-pentyl-N-2-propenyl-
CAS Number:
86967-47-7
Molecular Formula:
C13H27N
Molecular Weight:
197.3602
IUPAC Name:
N-pentyl-N-prop-2-enylpentan-1-amine
InChI:
InChI=1S/C13H27N/c1-4-7-9-12-14(11-6-3)13-10-8-5-2/h6H,3-5,7-13H2,1-2H3
InChI Key:
NGPBJVUPAJHRDY-UHFFFAOYSA-N
SMILES:
C=CCN(CCCCC)CCCCC
Properties
Complexity:
110
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
197.214g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
197.366g/mol
Monoisotopic Mass:
197.214g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
3.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.5
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