Browse
Submit Data
Databases
API
Help

Dataset Information

0 Views

0 Connections

0 Citations

0 Reanalyses

0 Downloads

Omics score: 0

2-(4-Hy-droxy-phen-oxy)propanoic acid.

ABSTRACT: In the title compound, C(9)H(10)O(4), the carboxyl group is oriented at a dihedral angle of 84.6?(3)° with respect to the benzene ring. In the crystal, mol-ecules are linked via O-H?O hydrogen bonds.

SUBMITTER: Gu Z

PROVIDER: S-EPMC3011595 | biostudies-literature | 2010 Nov

REPOSITORIES: biostudies-literature

ACCESS DATA

Json Xml

Publications

2-(4-Hy-droxy-phen-oxy)propanoic acid.

Gu Zhun Z Jia Hong-Sheng HS Cheng Wei W

Acta crystallographica. Section E, Structure reports online 20101130 Pt 12

In the title compound, C(9)H(10)O(4), the carboxyl group is oriented at a dihedral angle of 84.6 (3)° with respect to the benzene ring. In the crystal, mol-ecules are linked via O-H⋯O hydrogen bonds. ...[more]

PMID: 21589634

Similar Datasets

4-(5-Hy-droxy-meth-yl-2-meth-oxy-phen-oxy)benzoic acid.

Project description:The title compound, C(15)H(14)O(5), crystallizes with two independent mol-ecules in the asymmetric unit in which the benzene rings are inclined at dihedral angles of 79.4?(1) and 84.2?(1)°. In the crystal, inter-molecular O-H?O hydrogen bonds link the mol-ecules into double chains propagating in [001].

| S-EPMC3089302 | biostudies-literature

3-(2-Formyl-phen-oxy)propanoic acid.

Project description:In the structure of the title compound, C(10)H(10)O(4), the carboxyl group forms a catemer motif in the [100] direction instead of the expected dimeric structures. The carboxylic acid group is found in the syn conformation and the three-dimensional organization in the crystal is based on C-H?O and O-H?O interactions.

| S-EPMC2983121 | biostudies-literature

2-(4-Acetamido-phen-oxy)-2-methyl-propanoic acid.

Project description:In the title compound, C12H15NO4, the dihedral angle between the acetamide group and the ring is 29.6?(2)(su?)°. In the crystal mol-ecules are linked through N-H?O and O-H?O hydrogen bonds, thereby forming corrugated sheets propagating in the ac plane. These sheets are composed of R4(4)(28) graph-set motifs.

| S-EPMC3588439 | biostudies-literature

2-Methyl-2-(4-nitro-phen-oxy)propanoic acid.

Project description:The title compound, C(10)H(11)NO(5), is of inter-est with respect to its anti-dyslipidemic activity. It was prepared by reaction of 4-nitro-phenol with ethyl 2-bromo-2-methyl-propionate followed by ethyl ester hydrolysis. In the crystal, mol-ecules are linked into centrosymmetric dimers by inter-molecular O-H⋯O hydrogen bonds and the dimers are connected into chains by weak C-H⋯O inter-actions. The packing is further stabilized by offset π-π inter-actions between adjacent benzene rings with a centroid-centroid distance of 3.8643 (17) Å.

| S-EPMC2960050 | biostudies-literature

1-(2-Hy-droxy-4,5-dimeth-oxy-phen-yl)ethanone.

Project description:The mol-ecular structure of the title compound, C10H12O4, contains an intra-molecular hydrogen bond between the phenol and acetyl substituents. In the crystal, C-H?? inter-actions act between the mol-ecules in a cyclic manner to stabilize stacks of mol-ecules along the b axis. Several C-H?O inter-actions are present between the stacks.

| S-EPMC3588311 | biostudies-literature

1-(2-Hy-droxy-3,5-dimeth-oxy-phen-yl)ethanone.

Project description:In title compound, C(10)H(12)O(4), all of the non-H atoms lie approximately in a plane with the largest deviation being 0.061?(2)?Å. An intra-molecular O-H?O hydrogen bond generates an S(6) ring motif. No classical inter-molecular hydrogen bonding occurs, with only van der Waals forces stabilizing the crystal structure.

| S-EPMC3254463 | biostudies-literature

N-(4-Hy-droxy-phen-yl)-3,4,5-trimeth-oxy-benzamide.

Project description:In the title amide compound, C(16)H(17)NO(5), the dihedral angle between the benzene rings is 71.59?(4)°. In the crystal, inter-molecular N-H?O and O-H?O hydrogen bonds link the mol-ecules into a two-dimensional array parallel to the ab plane.

| S-EPMC3247600 | biostudies-literature

(E)-3-(4-Hy-droxy-3-meth-oxy-phen-yl)-1-(4-hy-droxy-phen-yl)prop-2-en-1-one.

Project description:In the title compound, C16H14O4, there is an intra-molecular O-H?O hydrogen bond. The benzene rings are inclined to one another by 13.89?(9)°. The prop-2-en-1-one group is twisted slightly, the O=C-Car-Car (ar = aromatic) and C=C-C=O torsion angles being -10.4?(3) and -7.4?(3)°, respectively. In the crystal, mol-ecules are linked by O-H?O hydrogen bonds, forming chains along [100]. These chains are further linked by O-H?O hydrogen bonds, forming corrugated sheets lying parallel to (010). There are C-H?? inter-actions present within the sheets.

| S-EPMC4011235 | biostudies-literature

(2-Hy-droxy-4-meth-oxy-phen-yl)(2-hy-droxy-phen-yl)methanone.

Project description:The title compound, C(14)H(12)O(4), is an asymmetric substitution product of benzophenone. Both hy-droxy groups are orientated towards the O atom of the keto group. Intra-molecular as well as inter-molecular O-H?O hydrogen bonds can be observed in the crystal structure, with the latter connecting the mol-ecules into chains along the crystallographic b axis. C-H?O contacts [C?O = 3.3297?(18)?Å] are also apparent. The closest centroid-centroid distance between two aromatic systems is 4.9186?(9)?Å.

| S-EPMC3213614 | biostudies-other

3-(2-Fluoro-phen-oxy)propanoic acid.

Project description:In the title compound, C(9)H(9)FO(3), the dihedral angle between the carboxyl group and the benzene ring is 79.4?(3)°. In the crystal, mol-ecules form centrosymmetric dimers through pairs of classical O-H?O hydrogen bonds. These are further linked by weaker C-H?O inter-actions, forming a three-dimensional network.

| S-EPMC3050240 | biostudies-other

OmicsDI is part of the ELIXIR infrastructure

OmicsDI is an Elixir interoperability service. Learn more ›

Tweets

OmicsDI Databases

PRIDE
PeptideAtlas
MassIVE
JPOST Repository
Physiome Model Repository

EGA
EVA
ENA
LINCS
PAXDB
Cell Collective

MetaboLights
Metabolomics Workbench
MetabolomeExpress
GNPS
BioModels
FAIRDOMHub

ArrayExpress
dbGaP
ExpressionAtlas
GEO
NODE

Information

Databases
Help
API
Contact us
Code on GitHub
Terms of use
Submit Data