2-Allyl-4-ethoxyphenol

CAT: 0926-SFA87524-01Size: 0.5 gDry Ice: NoHazardous: No

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CAT#:0926-SFA87524-01Size:0.5 g

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CAS Number

142875-24-9

MDL Number

MFCD05270920

Smiles

CCOC1=CC (=C (C=C1) O) CC=C

Molecular Formula

C11H14O2

Molecular Weight

178.23 g/mol

Controlled

Chemical Information

2-Allyl-4-ethoxyphenol

CAS Number	142875-24-9
PubChem CID	2104078
IUPAC Name	4-ethoxy-2-prop-2-enylphenol
Molecular Formula	C11H14O2
Molecular Weight	178.23
XLogP	3
Topological Polar Surface Area	29.5
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	4
Heavy Atom Count	13
Formal Charge	0
Complexity	156

SMILES

CCOC1=CC(=C(C=C1)O)CC=C

InChI

InChI=1S/C11H14O2/c1-3-5-9-8-10(13-4-2)6-7-11(9)12/h3,6-8,12H,1,4-5H2,2H3

InChIKey

MSNKNSRKIJBFMX-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 142875-24-9

CID: 2104078

Formula: C11H14O2

MW: 178.23

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	178.23
XLogP3	3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	4
Exact Mass	178.099379685
Monoisotopic Mass	178.099379685
Topological Polar Surface Area	29.5 Å²
Heavy Atom Count	13
Formal Charge	0
Complexity	156
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
FE61834-01	4-Ethoxyphenol
FA122353-01	2-Allyl-4-bromophenol
FA12114-01	4-Allyl-2-methoxyphenol
FA150954-01	2-Allyl-4-chlorophenol
AAA58482-01	2-Allyl-4-methoxyphenol
JCA89387-01	2-Allyl-4,5-dimethoxyphenol
FA11965	4-Allyl-2-methoxyphenol acetate
XWC80920-01	4-[ (4-Aminopiperidin-1-yl) methyl]-2-ethoxyphenol dihydrochloride
MBA96659-01	4-Amino-3-ethoxyphenol hydrochloride
QAA72780	Allyl 4-nitrobenzoate