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Trans-4-Methoxycinnamaldehyde

CAT: 0024-sc-272658Size: 10 gDry Ice: NoHazardous: No
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CAT#:0024-sc-272658Size:10 g
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CAS Number
24680-50-0

Chemical Information

p-METHOXYCINNAMALDEHYDE

3-(4-Methoxyphenyl)-2-propenal is a member of cinnamaldehydes.

CAS Number24680-50-0
PubChem CID641294
IUPAC Name(E)-3-(4-methoxyphenyl)prop-2-enal
Molecular FormulaC10H10O2
Molecular Weight162.18
XLogP1.8
Topological Polar Surface Area26.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count3
Heavy Atom Count12
Formal Charge0
Complexity155
SMILES
COC1=CC=C(C=C1)/C=C/C=O
InChI
InChI=1S/C10H10O2/c1-12-10-6-4-9(5-7-10)3-2-8-11/h2-8H,1H3/b3-2+
InChIKey
AXCXHFKZHDEKTP-NSCUHMNNSA-N
Chemical Structure
2D Structure
2D structure of p-METHOXYCINNAMALDEHYDE
CAS: 24680-50-0
CID: 641294
Formula: C10H10O2
MW: 162.18
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight162.18
XLogP31.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count3
Exact Mass162.068079557
Monoisotopic Mass162.068079557
Topological Polar Surface Area26.3 Ų
Heavy Atom Count12
Formal Charge0
Complexity155
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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