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146849-05-0 | 5-Hexen-3-ol, 4-ethoxy-3-ethyl-
CAS No: 146849-05-0 Catalog No: AG001EDO MDL No:
Product Description
Catalog Number:
AG001EDO
Chemical Name:
5-Hexen-3-ol, 4-ethoxy-3-ethyl-
CAS Number:
146849-05-0
Molecular Formula:
C10H20O2
Molecular Weight:
172.2646
IUPAC Name:
4-ethoxy-3-ethylhex-5-en-3-ol
InChI:
InChI=1S/C10H20O2/c1-5-9(12-8-4)10(11,6-2)7-3/h5,9,11H,1,6-8H2,2-4H3
InChI Key:
KVRLSAIRHRSHQR-UHFFFAOYSA-N
SMILES:
CCOC(C(CC)(CC)O)C=C
Properties
Complexity:
128
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
172.146g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
172.268g/mol
Monoisotopic Mass:
172.146g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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