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138236-26-7 | Cyclohexane, 1-(4-methoxy-3-buten-1-yl)-2-(methoxymethylene)-
CAS No: 138236-26-7 Catalog No: AG0018CO MDL No:
Product Description
Catalog Number:
AG0018CO
Chemical Name:
Cyclohexane, 1-(4-methoxy-3-buten-1-yl)-2-(methoxymethylene)-
CAS Number:
138236-26-7
Molecular Formula:
C13H22O2
Molecular Weight:
210.3126
IUPAC Name:
1-(4-methoxybut-3-enyl)-2-(methoxymethylidene)cyclohexane
InChI:
InChI=1S/C13H22O2/c1-14-10-6-5-8-12-7-3-4-9-13(12)11-15-2/h6,10-12H,3-5,7-9H2,1-2H3
InChI Key:
CBKLHSWNFKVHCC-UHFFFAOYSA-N
SMILES:
COC=CCCC1CCCCC1=COC
Properties
Complexity:
219
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
210.162g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
210.317g/mol
Monoisotopic Mass:
210.162g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
2
XLogP3:
3.3
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