Methyl 4- (2-Hydroxyethoxy) benzoate

CAT: 0024-sc-485269Size: 5 gDry Ice: NoHazardous: No

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CAT#:0024-sc-485269Size:5 g

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CAS Number

3204-73-7

Chemical Information

Benzoic acid, 4-(2-hydroxyethoxy)-, methyl ester

CAS Number	3204-73-7
PubChem CID	76670
IUPAC Name	methyl 4-(2-hydroxyethoxy)benzoate
Molecular Formula	C10H12O4
Molecular Weight	196.20
XLogP	1.6
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

COC(=O)C1=CC=C(C=C1)OCCO

InChI

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

InChIKey

VFBYWNSASHHPPA-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 3204-73-7

CID: 76670

Formula: C10H12O4

MW: 196.20

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	196.20
XLogP3	1.6
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
sc-486878	Methyl 4- (2-Hydroxyethoxy) salicylate
sc-328228	Methyl 2-[ (2,4-difluorophenoxy) methyl]benzoate
sc-483759	Methyl 4- (2-Iodoethyl) benzoate
sc-328596	Methyl 4- (2-aminophenoxy) benzoate
sc-263600A	Methyl 4- (2-bromoethoxy) benzoate
sc-263600	Methyl 4- (2-bromoethoxy) benzoate
sc-235751	Methyl 4- (2-acetylaminoethyl) benzoate
sc-353935	Methyl 4-{[ (2-chloropropanoyl) amino]methyl}benzoate
sc-353935A	Methyl 4-{[ (2-chloropropanoyl) amino]methyl}benzoate
sc-491577	N7-[ (2-Hydroxyethoxy) methyl) guanine

Catalog	Name
FM70524-01	Methyl 4 (2-hydroxyethoxy) benzoate
KHD00727-01	Methyl 4-amino-3- (2-hydroxyethoxy) benzoate hydrochloride
DEA34227-01	Methyl 2-[ (chlorosulfonyl) methyl]benzoate
OR5788-01	Methyl 2-[ (sulphamoyl) methyl]benzoate
HGA65197-01	Methyl 2-[ (ethylsulfanyl) methyl]benzoate
EEC95370-01	Methyl 2-[ (fluorosulfonyl) methyl]benzoate
OR929284-01	Methyl 2-[ (dimethylamino) methyl]benzoate
FH 2C 216A-01	Methyl 2-[ (2-acetylphenoxy) methyl]benzoate
FH 1B 019C-01	Methyl 2-[ (2-methoxycarbonylphenyl) methyl]benzoate
VFA88995-01	Methyl 2- (methylsulfamoyl) benzoate