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13218-03-6 | 4-Penten-1-amine, N-propyl-
CAS No: 13218-03-6 Catalog No: AG0010CR MDL No:
Product Description
Catalog Number:
AG0010CR
Chemical Name:
4-Penten-1-amine, N-propyl-
CAS Number:
13218-03-6
Molecular Formula:
C8H17N
Molecular Weight:
127.2273
IUPAC Name:
N-propylpent-4-en-1-amine
InChI:
InChI=1S/C8H17N/c1-3-5-6-8-9-7-4-2/h3,9H,1,4-8H2,2H3
InChI Key:
SPYKROYIAAYYAN-UHFFFAOYSA-N
SMILES:
CCCNCCCC=C
Properties
Complexity:
59.6
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
127.136g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
127.231g/mol
Monoisotopic Mass:
127.136g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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