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114020-90-5 | Cyclohexene, 1-[(1-methoxy-1-methylethoxy)methyl]-
CAS No: 114020-90-5 Catalog No: AG000AC9 MDL No:
Product Description
Catalog Number:
AG000AC9
Chemical Name:
Cyclohexene, 1-[(1-methoxy-1-methylethoxy)methyl]-
CAS Number:
114020-90-5
Molecular Formula:
C11H20O2
Molecular Weight:
184.2753
IUPAC Name:
1-(2-methoxypropan-2-yloxymethyl)cyclohexene
InChI:
InChI=1S/C11H20O2/c1-11(2,12-3)13-9-10-7-5-4-6-8-10/h7H,4-6,8-9H2,1-3H3
InChI Key:
XVAKNSXRQXHHEX-UHFFFAOYSA-N
SMILES:
COC(OCC1=CCCCC1)(C)C
Properties
Complexity:
183
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
184.146g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
184.279g/mol
Monoisotopic Mass:
184.146g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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