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Anisaldehyde Dimethyl Acetal

CAT: 0572-TRC-A673205-1GSize: 1 gDry Ice: NoHazardous: No
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CAT#:0572-TRC-A673205-1GSize:1 g
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
2186-92-7
Synonyms
1-(Dimethoxymethyl)-4-methoxybenzene; (p-Methoxyphenyl)dimethoxymethane; 4-Anisaldehyde Dimethyl Acetal; 4-Methoxybenzaldehyde Dimethyl Acetal; Anisaldehyde dimethyl Acetal; Anisic aldehyde Dimethyl Acetal; Dimethoxy(4-methoxyphenyl)methane; p-(Dimethoxymethyl)anisole; p-Methoxybenzaldehyde Dimethyl Acetal;
Hazard Statement
Not a hazardous substance according to GHS.
Purity
>95% (HPLC)
Smiles
O=C(N([H])[C@H](C(N)=O)C(C)C)C1=C2C=CC=CC2=NN1CC3CCCCC3
Molecular Formula
C10H14O3
Molecular Weight
182.22
Shipping Conditions
Room Temperature
Storage Conditions
+4°C

Chemical Information

p-(Dimethoxymethyl)anisole
CAS Number2186-92-7
PubChem CID75140
IUPAC Name1-(dimethoxymethyl)-4-methoxybenzene
Molecular FormulaC10H14O3
Molecular Weight182.22
XLogP1.5
Topological Polar Surface Area27.7
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count4
Heavy Atom Count13
Formal Charge0
Complexity126
SMILES
COC1=CC=C(C=C1)C(OC)OC
InChI
InChI=1S/C10H14O3/c1-11-9-6-4-8(5-7-9)10(12-2)13-3/h4-7,10H,1-3H3
InChIKey
NNHYAHOTXLASEA-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of p-(Dimethoxymethyl)anisole
CAS: 2186-92-7
CID: 75140
Formula: C10H14O3
MW: 182.22
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight182.22
XLogP31.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count4
Exact Mass182.094294304
Monoisotopic Mass182.094294304
Topological Polar Surface Area27.7 Ų
Heavy Atom Count13
Formal Charge0
Complexity126
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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