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70862-18-9 | 1,4-Butanediamine, N-propyl-
CAS No: 70862-18-9 Catalog No: AG005FTJ MDL No:
Product Description
Catalog Number:
AG005FTJ
Chemical Name:
1,4-Butanediamine, N-propyl-
CAS Number:
70862-18-9
Molecular Formula:
C7H18N2
Molecular Weight:
130.2312
IUPAC Name:
N'-propylbutane-1,4-diamine
InChI:
InChI=1S/C7H18N2/c1-2-6-9-7-4-3-5-8/h9H,2-8H2,1H3
InChI Key:
GHQFRBNLAGNQOE-UHFFFAOYSA-N
SMILES:
CCCNCCCCN
Properties
Complexity:
46.2
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
130.147g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
130.235g/mol
Monoisotopic Mass:
130.147g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
38A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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