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4,4'-Dimethoxybenzhydrol

CAT: 0572-TRC-D440130-5GSize: 5 gDry Ice: NoHazardous: No
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CAT#:0572-TRC-D440130-5GSize:5 g
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
728-87-0
Synonyms
4-Methoxy-alpha-(4-methoxyphenyl)benzenemethanol; 4,4'-Dimethoxydiphenylcarbinol; 4-Methoxy-4'-methoxybenzhydrol; 4-Methoxy-alpha-(4-methoxyphenyl)benzenemethanol; Bis(4-methoxyphenyl)methanol; Bis(p-methoxyphenyl)carbinol; Bis(p-methoxyphenyl)methanol; NSC 5256; p,p'-Dimethoxybenzhydrol;
Hazard Statement
No Data Available
Smiles
COc1ccc(cc1)C(O)c2ccc(OC)cc2
Molecular Formula
C15H16O3
Molecular Weight
244.29
Shipping Conditions
Room Temperature
Storage Conditions
-20°C

Chemical Information

p,p'-Dimethoxybenzhydryl alcohol
CAS Number728-87-0
PubChem CID69768
IUPAC Namebis(4-methoxyphenyl)methanol
Molecular FormulaC15H16O3
Molecular Weight244.28
XLogP2.7
Topological Polar Surface Area38.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count4
Heavy Atom Count18
Formal Charge0
Complexity204
SMILES
COC1=CC=C(C=C1)C(C2=CC=C(C=C2)OC)O
InChI
InChI=1S/C15H16O3/c1-17-13-7-3-11(4-8-13)15(16)12-5-9-14(18-2)10-6-12/h3-10,15-16H,1-2H3
InChIKey
ZODAOVNETBTTJX-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of p,p'-Dimethoxybenzhydryl alcohol
CAS: 728-87-0
CID: 69768
Formula: C15H16O3
MW: 244.28
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight244.28
XLogP32.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count4
Exact Mass244.109944368
Monoisotopic Mass244.109944368
Topological Polar Surface Area38.7 Ų
Heavy Atom Count18
Formal Charge0
Complexity204
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

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