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18240-10-3 | 3-Cyclohexene-1-ethanol
CAS No: 18240-10-3 Catalog No: AG0023UH MDL No:
Product Description
Catalog Number:
AG0023UH
Chemical Name:
3-Cyclohexene-1-ethanol
CAS Number:
18240-10-3
Molecular Formula:
C8H14O
Molecular Weight:
126.1962
IUPAC Name:
2-cyclohex-3-en-1-ylethanol
InChI:
InChI=1S/C8H14O/c9-7-6-8-4-2-1-3-5-8/h1-2,8-9H,3-7H2
InChI Key:
FELLSOCIMJMONP-UHFFFAOYSA-N
SMILES:
OCCC1CCC=CC1
EC Number:
242-115-0
Properties
Complexity:
96.7
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
126.104g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
126.199g/mol
Monoisotopic Mass:
126.104g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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