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864684-71-9 | Benzene,(2,2-dimethoxy-1-methylethoxy)-
CAS No: 864684-71-9 Catalog No: AG004MZP MDL No:
Product Description
Catalog Number:
AG004MZP
Chemical Name:
Benzene,(2,2-dimethoxy-1-methylethoxy)-
CAS Number:
864684-71-9
Molecular Formula:
C11H16O3
Molecular Weight:
196.2429
IUPAC Name:
1,1-dimethoxypropan-2-yloxybenzene
InChI:
InChI=1S/C11H16O3/c1-9(11(12-2)13-3)14-10-7-5-4-6-8-10/h4-9,11H,1-3H3
InChI Key:
QVLIQNHHKKTDPG-UHFFFAOYSA-N
SMILES:
COC(C(Oc1ccccc1)C)OC
Properties
Complexity:
140
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.11g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
196.246g/mol
Monoisotopic Mass:
196.11g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
27.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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