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4-Isopropylanisole

CAT: 0024-sc-232793Size: 25 gDry Ice: NoHazardous: No
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CAT#:0024-sc-232793Size:25 g
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CAS Number
4132-48-3

Chemical Information

4-Isopropylanisole

4-Isopropylanisole has been reported in Glycyrrhiza glabra with data available.

CAS Number4132-48-3
PubChem CID77783
IUPAC Name1-methoxy-4-propan-2-ylbenzene
Molecular FormulaC10H14O
Molecular Weight150.22
XLogP3.4
Topological Polar Surface Area9.2
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count2
Heavy Atom Count11
Formal Charge0
Complexity101
SMILES
CC(C)C1=CC=C(C=C1)OC
InChI
InChI=1S/C10H14O/c1-8(2)9-4-6-10(11-3)7-5-9/h4-8H,1-3H3
InChIKey
JULZQKLZSNOEEJ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 4-Isopropylanisole
CAS: 4132-48-3
CID: 77783
Formula: C10H14O
MW: 150.22
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight150.22
XLogP33.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count2
Exact Mass150.104465066
Monoisotopic Mass150.104465066
Topological Polar Surface Area9.2 Ų
Heavy Atom Count11
Formal Charge0
Complexity101
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes