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85412-55-1 | 2-Nonyn-1-amine, N,N-diethyl-
CAS No: 85412-55-1 Catalog No: AG004SX4 MDL No:
Product Description
Catalog Number:
AG004SX4
Chemical Name:
2-Nonyn-1-amine, N,N-diethyl-
CAS Number:
85412-55-1
Molecular Formula:
C13H25N
Molecular Weight:
195.3443
IUPAC Name:
N,N-diethylnon-2-yn-1-amine
InChI:
InChI=1S/C13H25N/c1-4-7-8-9-10-11-12-13-14(5-2)6-3/h4-10,13H2,1-3H3
InChI Key:
UODFGRXFNTXCLY-UHFFFAOYSA-N
SMILES:
CCCCCCC#CCN(CC)CC
Properties
Complexity:
168
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
195.199g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
195.35g/mol
Monoisotopic Mass:
195.199g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
3.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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