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octan-4-amine

CAS No.:
1117-33-5
Catalog Number:
AG019U00
Molecular Formula:
C8H19N
Molecular Weight:
129.2432
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Product Description
Catalog Number:
AG019U00
Chemical Name:
octan-4-amine
CAS Number:
1117-33-5
Molecular Formula:
C8H19N
Molecular Weight:
129.2432
MDL Number:
MFCD11655388
IUPAC Name:
octan-4-amine
InChI:
InChI=1S/C8H19N/c1-3-5-7-8(9)6-4-2/h8H,3-7,9H2,1-2H3
InChI Key:
PSBKYMODPYHLAW-UHFFFAOYSA-N
SMILES:
CCCCC(CCC)N
Properties
Complexity:
52.5  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
129.152g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
129.247g/mol
Monoisotopic Mass:
129.152g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Properties