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89635-80-3 | 1-Propyne, 3-[2-(2-ethoxyethoxy)ethoxy]-
CAS No: 89635-80-3 Catalog No: AG003WIO MDL No:
Product Description
Catalog Number:
AG003WIO
Chemical Name:
1-Propyne, 3-[2-(2-ethoxyethoxy)ethoxy]-
CAS Number:
89635-80-3
Molecular Formula:
C9H16O3
Molecular Weight:
172.2215
IUPAC Name:
3-[2-(2-ethoxyethoxy)ethoxy]prop-1-yne
InChI:
InChI=1S/C9H16O3/c1-3-5-11-8-9-12-7-6-10-4-2/h1H,4-9H2,2H3
InChI Key:
NIFIKPHRYNDRRF-UHFFFAOYSA-N
SMILES:
CCOCCOCCOCC#C
Properties
Complexity:
125
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
172.11g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
172.224g/mol
Monoisotopic Mass:
172.11g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
27.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
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