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101568-15-4 | 1-Hexen-1-ol, 2-ethyl-
CAS No: 101568-15-4 Catalog No: AG0004TS MDL No:
Product Description
Catalog Number:
AG0004TS
Chemical Name:
1-Hexen-1-ol, 2-ethyl-
CAS Number:
101568-15-4
Molecular Formula:
C8H16O
Molecular Weight:
128.2120
IUPAC Name:
2-ethylhex-1-en-1-ol
InChI:
InChI=1S/C8H16O/c1-3-5-6-8(4-2)7-9/h7,9H,3-6H2,1-2H3
InChI Key:
MMELVRLTDGKXGU-UHFFFAOYSA-N
SMILES:
CCCCC(=CO)CC
Properties
Complexity:
84.6
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
128.12g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
128.215g/mol
Monoisotopic Mass:
128.12g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
3.3
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