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20726-67-4 | 2,4-Hexadiyne, 1,6-dimethoxy-
CAS No: 20726-67-4 Catalog No: AG002IY3 MDL No:
Product Description
Catalog Number:
AG002IY3
Chemical Name:
2,4-Hexadiyne, 1,6-dimethoxy-
CAS Number:
20726-67-4
Molecular Formula:
C8H10O2
Molecular Weight:
138.1638
IUPAC Name:
1,6-dimethoxyhexa-2,4-diyne
InChI:
InChI=1S/C8H10O2/c1-9-7-5-3-4-6-8-10-2/h7-8H2,1-2H3
InChI Key:
WAPCAIUCRKHCNY-UHFFFAOYSA-N
SMILES:
COCC#CC#CCOC
Properties
Complexity:
168
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
138.068g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
138.166g/mol
Monoisotopic Mass:
138.068g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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