Home Other Building Blocks (but-3-yn-1-yl)diethylamine

(but-3-yn-1-yl)diethylamine

CAS No.:
29777-09-1
Catalog Number:
AG01BDZM
Molecular Formula:
C8H15N
Molecular Weight:
125.2114
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Product Description
Catalog Number:
AG01BDZM
Chemical Name:
(but-3-yn-1-yl)diethylamine
CAS Number:
29777-09-1
Molecular Formula:
C8H15N
Molecular Weight:
125.2114
MDL Number:
MFCD18841239
IUPAC Name:
N,N-diethylbut-3-yn-1-amine
InChI:
InChI=1S/C8H15N/c1-4-7-8-9(5-2)6-3/h1H,5-8H2,2-3H3
InChI Key:
CGSBVEHGUHCRCB-UHFFFAOYSA-N
SMILES:
CCN(CCC#C)CC
Properties
Complexity:
94.4  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
125.12g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
125.215g/mol
Monoisotopic Mass:
125.12g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
3.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties