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130018-34-7 | 1-Pentyne, 5-(2-propen-1-yloxy)-
CAS No: 130018-34-7 Catalog No: AG000TX6 MDL No:
Product Description
Catalog Number:
AG000TX6
Chemical Name:
1-Pentyne, 5-(2-propen-1-yloxy)-
CAS Number:
130018-34-7
Molecular Formula:
C8H12O
Molecular Weight:
124.1803
IUPAC Name:
5-prop-2-enoxypent-1-yne
InChI:
InChI=1S/C8H12O/c1-3-5-6-8-9-7-4-2/h1,4H,2,5-8H2
InChI Key:
VQQOWEQSNADJAZ-UHFFFAOYSA-N
SMILES:
C=CCOCCCC#C
Properties
Complexity:
107
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
124.089g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
124.183g/mol
Monoisotopic Mass:
124.089g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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