4- (2-Methoxy-ethoxy) -benzoic acid

CAT: 0926-CBA89092-01Size: 1 gDry Ice: NoHazardous: No

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CAT#:0926-CBA89092-01Size:1 g

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CAS Number

27890-92-2

MDL Number

MFCD07187813

Smiles

COCCOC1=CC=C (C=C1) C (=O) O

Molecular Formula

C10H12O4

Molecular Weight

196.2 g/mol

Controlled

Chemical Information

4-(2-Methoxyethoxy)benzoic acid

CAS Number	27890-92-2
PubChem CID	6485562
IUPAC Name	4-(2-methoxyethoxy)benzoic acid
Molecular Formula	C10H12O4
Molecular Weight	196.20
XLogP	1.9
Topological Polar Surface Area	55.8
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	5
Heavy Atom Count	14
Formal Charge	0
Complexity	173

SMILES

COCCOC1=CC=C(C=C1)C(=O)O

InChI

InChI=1S/C10H12O4/c1-13-6-7-14-9-4-2-8(3-5-9)10(11)12/h2-5H,6-7H2,1H3,(H,11,12)

InChIKey

YBICPDGCVIUHNA-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 27890-92-2

CID: 6485562

Formula: C10H12O4

MW: 196.20

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	196.20
XLogP3	1.9
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	5
Exact Mass	196.07355886
Monoisotopic Mass	196.07355886
Topological Polar Surface Area	55.8 Å²
Heavy Atom Count	14
Formal Charge	0
Complexity	173
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
RQB82967-01	3-Ethoxy-4- (2-methoxy-2-oxoethoxy) benzoic acid
KBC20424-01	4-Methoxy-2-[2- (propan-2-yloxy) ethoxy]benzoic acid
HGC12629-01	4-Methoxy-2-[2- (thiophen-3-yl) ethoxy]benzoic acid
EMB97544-01	4-[2- (4-Phenoxyphenoxy) ethoxy]benzoic acid
YIB94791	2-Methoxy-4- (trifluoromethoxy) benzoic acid
XCA85673-01	2-Methoxy-4- (methylsulfanyl) benzoic acid
FM70024-01	4-Methoxy-2- (trifluoromethyl) benzoic acid
GKA93625-01	2-Methoxy-4- (methoxycarbonyl) benzoic acid
NBA95744-01	2- (4-Methoxy-benzenesulfonylamino) -benzoic acid
WXA15608-01	3-Ethoxy-4- (2-phenoxyethoxy) benzoic acid

Catalog	Name
428657-01	4- (2-Methoxy-ethoxy) -benzoic acid
PC1016983-01	4-Ethoxy-5-methoxy-2- (trifluoromethyl) benzoic acid
AR-B01336-01	2-Ethoxy Benzoic Acid
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LC-10224.1	2-Ethoxy benzoic acid pure
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OR8666	2-[2- (Dimethylamino) ethoxy]benzoic acid
OR962563-01	2- (2-Hydroxy-ethoxy) -benzoic acid
sc-273793	2- (2-Phenoxy-ethoxy) -benzoic acid
sc-304644	2- (2-Dimethylamino-ethoxy) -benzoic acid